ethyl 4-(3-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(3-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoate
ethyl 4-(3-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoate
Compound characteristics
| Compound ID: | 8015-8739 |
| Compound Name: | ethyl 4-(3-{[(1H-benzimidazol-2-yl)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoate |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C21 H19 N3 O4 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(CC(C1=O)SCc1nc2ccccc2[nH]1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0505 |
| logD: | 3.0489 |
| logSw: | -3.2184 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.193 |
| InChI Key: | ZWYMZYZDIWHUOJ-KRWDZBQOSA-N |