2-bromo-N-[1,3-dimethyl-2-oxo-6-(phenylsulfanyl)-2,3-dihydro-1H-benzimidazol-5-yl]benzamide
Chemical Structure Depiction of
2-bromo-N-[1,3-dimethyl-2-oxo-6-(phenylsulfanyl)-2,3-dihydro-1H-benzimidazol-5-yl]benzamide
2-bromo-N-[1,3-dimethyl-2-oxo-6-(phenylsulfanyl)-2,3-dihydro-1H-benzimidazol-5-yl]benzamide
Compound characteristics
| Compound ID: | F431-0012 |
| Compound Name: | 2-bromo-N-[1,3-dimethyl-2-oxo-6-(phenylsulfanyl)-2,3-dihydro-1H-benzimidazol-5-yl]benzamide |
| Molecular Weight: | 468.37 |
| Molecular Formula: | C22 H18 Br N3 O2 S |
| Smiles: | CN1C(N(C)c2cc(c(cc12)NC(c1ccccc1[Br])=O)Sc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0092 |
| logD: | 5.0088 |
| logSw: | -4.5667 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.045 |
| InChI Key: | PBQAUCLRBGERMN-UHFFFAOYSA-N |