N-(2-bromophenyl)-2-{[4-(pyridin-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-bromophenyl)-2-{[4-(pyridin-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
N-(2-bromophenyl)-2-{[4-(pyridin-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C201-1778 |
| Compound Name: | N-(2-bromophenyl)-2-{[4-(pyridin-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 465.37 |
| Molecular Formula: | C22 H17 Br N4 O S |
| Smiles: | C1C(c2ccccn2)=Nc2ccccc2N=C1SCC(Nc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8811 |
| logD: | 3.8798 |
| logSw: | -4.2238 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.689 |
| InChI Key: | IGALTAILIHVUIV-UHFFFAOYSA-N |