2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Chemical Structure Depiction of
2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Compound characteristics
| Compound ID: | C200-6659 |
| Compound Name: | 2-{[4-(3-methoxyphenyl)-3H-1,5-benzodiazepin-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide |
| Molecular Weight: | 465.57 |
| Molecular Formula: | C28 H23 N3 O2 S |
| Smiles: | COc1cccc(c1)C1CC(=Nc2ccccc2N=1)SCC(Nc1cccc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.28 |
| logD: | 5.2793 |
| logSw: | -6.1893 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.913 |
| InChI Key: | KIFFTUSBCCVVNB-UHFFFAOYSA-N |