N-{6-[(4-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{6-[(4-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{6-[(4-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | F431-0545 |
| Compound Name: | N-{6-[(4-chlorophenyl)sulfanyl]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 467.93 |
| Molecular Formula: | C23 H18 Cl N3 O4 S |
| Smiles: | CN1C(N(C)c2cc(c(cc12)NC(c1ccc2c(c1)OCO2)=O)Sc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4021 |
| logD: | 5.4021 |
| logSw: | -5.9735 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.16 |
| InChI Key: | MLADFYSHQBUSOI-UHFFFAOYSA-N |