| Phytochemical Name : Aminophylline |
| PCNDIDA0118 |
| Pubchem CID : 9433 |
| Molecular formula: C16H24N10O4 |
| Canonical SMILES : CN1C2=C(C(=O)N(C1=O)C)NC=N2.CN1C2=C(C(=O)N(C1=O)C)NC=N2.C(CN)N |
Synonymes : aminophylline|317-34-0|Aminophyllin|Cardophyllin|Phyllocontin|Linampheta|Somophyllin|Syntophyllin|Theophyllamine|Truphylline|Aminodur|Theophylline ethylenediamine|Methophylline|Theophyllaminum|Variaphylline|Aminocardol|Cardiofilina|Cardiomin|Cardophylin|Cariomin|Diaphylline|Diophllin|Diuxanthine|Ethophylline|Euphyllin|Eurphyllin|Euufillin|Genophyllin|Grifomin|Inophylline|Lixaminol|Metaphyllin|Metaphylline|Minaphil|Miofilin|Neophyiline|Norofilina|Peterphyllin|Phylcardin|Phyllindon|Stenovasan|Theodrox|Theolamine|Theolone|Theophyldine|Thephyldine|Vasofilina|Carena|Lasodex|Aminophyllinum|Ammophyllin|Diaphilline|Diophyllin|Euphyllinum|Eufilina|Euufilin|Tefamin|Theomin|Theophyllaminium|Euphylline|Somophyllin O|DOBO|Rectalad aminophylline|Theophyline ethylenediamine|Aminodur dura-tabs|Aminofillina|Aminofilina|Theophyllin aethylendiamin|Rectalad-aminophylline|Aminophylline Dye Free|Theophyllin ethylenediamine|Aminophylline ethylenediamine|Etilen-xantisan tabl.|Dura-Tab S.M. Aminophylline|Dura-tab sm aminophylline|Eufilina [Polish]|Aminofillina [DCIT]|Aminofilina [Spanish]|BY 108|TH/100|HSDB 221|Theophyllinum et ethylendiaminum|Etilen-Xantisan|Theophylline compound with ethylenediamine|Aminofilina [INN-Spanish]|NSC 7919|Aminophyllinum [INN-Latin]|EINECS 206-264-5|Theophylline-Ethylenediamine Anhydrous|Pulmophyllin (new)|Diaphyllin|Mudrane GG Tablets|Phyllotemp|Theophylline, compd with ethylenediamine (2:1)|Pulmophylline (new)|UNII-27Y3KJK423|Theophylline compound with ethylenediamine (2:1)|Mudrane GG-2 Tablets|27Y3KJK423|Theophyllin aethylendiamin [German]|NSC-7919|AMINOPHYLLINE IN SODIUM CHLORIDE 0.45%|Aminophylline (Truphylline)|Aminophylline [INN:BAN:JAN]|CHEBI:2659|DTXSID40883359|Theophylline-ethylenediamine|AMINOPHYLLINE IN SODIUM CHLORIDE 0.45% IN PLASTIC CONTAINER|Aminophylline [USP:INN:BAN:JAN]|1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, compd with 1,2-ethanediamine (2:1)|THEOPHYLLINE AND ETHYLENEDIAMINE|Aminophylline Anhydrous|1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione compound with ethane-1,2-diamine (2:1)|AMINOPHYLLINE (MART.)|AMINOPHYLLINE [MART.]|Somopphyllin|AMINOPHYLLINE (USP MONOGRAPH)|AMINOPHYLLINE [USP MONOGRAPH]|Euphyllin Retard|1,3-Dimethyl-3,7-dihydro-1H-purine-2,6-dione hemiethane-1,2-diamine salt|C7H8N4O2.xC2H8N2|3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, compd with 1,2-ethanediamine (2:1)|Mundiphyllin Retard|NSC7919|95646-60-9|CARINE|THEOPHYLLINE-ETHYLENEDIAMINE (EP MONOGRAPH)|THEOPHYLLINE-ETHYLENEDIAMINE [EP MONOGRAPH]|C7-H8-N4-O2.x-C2-H8-N2|Ethylenediamine, Theophylline|THEOPHYLLINE-ETHYLENEDIAMINE ANHYDROUS (EP IMPURITY)|THEOPHYLLINE-ETHYLENEDIAMINE ANHYDROUS [EP IMPURITY]|Cidophylline|A 1755|Euphyllin CR|Prestwick_93|Somophyllin (TN)|C16H24N10O4|Etilen-xantisan tabl|MFCD00013221|1,3-dimethyl-7H-purine-2,6-dione; ethane-1,2-diamine|Ammonium Carbonate NF|Aminophylline, anhydrous|Lopac-A-1755|Aminophylline (USP/INN)|AMINOPHYLLINE [MI]|AMINOPHYLLINE [INN]|SCHEMBL5037|AMINOPHYLLINE [HSDB]|AMINOPHYLLINE [INCI]|AMINOPHYLLINE [VANDF]|Aminophylline Anhydrous Powder|AMINOPHYLLINE [WHO-DD]|AMINOPHYLLINE [WHO-IP]|Aminophylline [BAN:INN:JAN]|Aminophylline, >=98%, powder|CHEMBL1370561|Theophylline ethylenediamine (TN)|DTXCID101022896|HMS1570D21|HMS2097D21|HMS3260C09|HMS3655A19|HMS3714D21|HMS3884G06|AMINOPHYLLINE [ORANGE BOOK]|BCP23387|HY-B0140|teofilina compuesto con etilendiamina|Tox21_500014|s1673|AMINOPHYLLINUM [WHO-IP LATIN]|AKOS015951253|AKOS015960458|theophylline compd with ethylenediamine|BCP9000293|CCG-220820|CCG-221318|CS-1936|CS-O-11593|DB01223|KS-5340|LP00014|Aminophylline(Phyllocontin, Truphylline)|NCGC00016113-01|NCGC00016113-02|NCGC00016113-03|NCGC00093539-01|NCGC00260699-01|AC-11138|BA166016|CAS-317-34-0|BCP0726000247|LS-149548|A2805|EU-0100014|FT-0622295|SW199286-2|C7-H8-N4-O2.1/2C2-H8-N2|teofilina, compuesto con etilendiamina (2:1)|D00227|Etilendiamina, compuesto con la teofilina(1:2)|I10006|A875823|EN300-18532624|Q471763|SR-01000872628|SR-01000872628-1|W-106881|1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione-ethane-1,2-diamine (2:1)|1,3-Dimethyl-3,7-dihydro-1H-purine-2,6-dionehemiethane-1,2-diaminesalt|1,2-etanodiamina, compuesto con 3,7-dihidro-1,3-dimetil-1H-purina-2,6-diona(1:2)|1,3-dimethyl-1H-purine-2,6(3H,7H)-dione compound with ethane-1,2-diamine (2:1)|1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione - ethane-1,2-diamine (2:1)|1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione compound with ethane-1,2-diamine (2:1)|1H-purina-2,6-diona,3,7-dihidro-1,3-dimetil-, compuesto. con 1,2-etanodiamina (2:1)|1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, compound with 1,2-ethanediamine (2:1)|1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, compound with 1,2-Ethanediamine(2:1)|3,9-Dihydro-1,3-dimethyl-1H-purine-2,6-dione compd with 1,2-ethanediamine (2:1)|bis(1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione); ethane-1,2-diamine |
| Structure | |
| 3D structure | 2D structure |
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| Log Po/w (iLOGP) : 2.470 |
| Log Po/w (XLOGP3) : -2.060 |
| Log Po/w (WLOGP) : -3.180 |
| Log Po/w (MLOGP) : -1.640 |
| Log Po/w (SILICOS-IT) : 0.120 |
| Consensus Log Po/w : -0.860 |

