| Phytochemical Name : Isatin |
| PCNDIDI0038 |
| Pubchem CID : 7054 |
| Molecular formula: C8H5NO2 |
| Canonical SMILES : C1=CC=C2C(=C1)C(=O)C(=O)N2 |
Synonymes : Isatin|91-56-5|1H-Indole-2,3-dione|2,3-Indolinedione|Indoline-2,3-dione|INDOLE-2,3-DIONE|Isatine|Tribulin|Pseudoisatin|2,3-Dioxoindoline|2,3-Diketoindoline|Isatic acid lactam|Isotin|Isatinic acid anhydride|2,3-Ketoindoline|o-Aminobenzoylformic anhydride|2,3-dihydro-1H-indole-2,3-dione|2,3-Dioxo-2,3-dihydroindole|NSC 9262|84788-92-1|EINECS 202-077-8|MFCD00005718|BRN 0383659|AI3-03111|2,3-dihydroindole-2,3-dione|CHEMBL326294|1186480-61-4|DTXSID3038694|UNII-82X95S7M06|CHEBI:27539|NSC-9262|82X95S7M06|EC 202-077-8|5-21-10-00221 (Beilstein Handbook Reference)|3-Indolinedione|indol-2|Indole-2|hydroxy-3-indolone|indolin-2,3-dion|Isatin, p.a.|3-hydroxy-2-indolone|Isatin (Compound 1)|Isatin, technical grade|2H-indole-2,3-dione|ISATIN [INCI]|ISATIN [MI]|D03NEO|D0SP2O|WLN: T56 BMVVJ|3-Hydroxy-2H-indol-2-one|SCHEMBL34016|MLS001066355|DTXCID1018694|2,3-Dihydro-indole-2,3-dione|BDBM11022|NSC9262|HMS2267D18|HMS3885P18|S00335a|BCP15996|HY-Y0265|2,3-dihydro-1H-indol-2,3-dione|Tox21_202876|s4717|STK387523|AKOS000119125|CCG-266182|CS-W020128|DB02095|SB64041|CAS-91-56-5|NCGC00246983-01|NCGC00260422-01|AC-10666|AS-10908|LS-83004|SMR000471835|SY005277|AM20050218|BB 0295136|FT-0627212|FT-0728767|I0080|EN300-17956|D70304|I-7800|I-7801|A843979|Q421348|F9995-1662|Isatin, for spectrophotometric det. of proline and thiophene, >=99.0%|Indoline-2,3-dione;2,3-Dioxo-2,3-dihydroindole; Isatic acid lactam; Isotin |
| Structure | |
| 3D structure | 2D structure |
![]() |
| Log Po/w (iLOGP) : 0.830 |
| Log Po/w (XLOGP3) : 0.830 |
| Log Po/w (WLOGP) : 0.250 |
| Log Po/w (MLOGP) : 0.170 |
| Log Po/w (SILICOS-IT) : 1.550 |
| Consensus Log Po/w : 0.720 |

