4-bromo-N-[6-(butylsulfanyl)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[6-(butylsulfanyl)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]benzamide
4-bromo-N-[6-(butylsulfanyl)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]benzamide
Compound characteristics
| Compound ID: | F431-0478 |
| Compound Name: | 4-bromo-N-[6-(butylsulfanyl)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]benzamide |
| Molecular Weight: | 448.38 |
| Molecular Formula: | C20 H22 Br N3 O2 S |
| Smiles: | CCCCSc1cc2c(cc1NC(c1ccc(cc1)[Br])=O)N(C)C(N2C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6473 |
| logD: | 5.6347 |
| logSw: | -5.2688 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.317 |
| InChI Key: | RCKNKJSNCJHWQU-UHFFFAOYSA-N |