4-(2-{[4-(pyridin-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamido)benzamide
Chemical Structure Depiction of
4-(2-{[4-(pyridin-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamido)benzamide
4-(2-{[4-(pyridin-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamido)benzamide
Compound characteristics
| Compound ID: | C201-1956 |
| Compound Name: | 4-(2-{[4-(pyridin-2-yl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}acetamido)benzamide |
| Molecular Weight: | 429.5 |
| Molecular Formula: | C23 H19 N5 O2 S |
| Smiles: | C1C(c2ccccn2)=Nc2ccccc2N=C1SCC(Nc1ccc(cc1)C(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2642 |
| logD: | 2.2626 |
| logSw: | -2.7552 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.446 |
| InChI Key: | GZXYJYLVCUFVMD-UHFFFAOYSA-N |