2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-(2-methoxy-5-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-(2-methoxy-5-methylphenyl)acetamide
2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-(2-methoxy-5-methylphenyl)acetamide
Compound characteristics
| Compound ID: | L389-0020 |
| Compound Name: | 2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-(2-methoxy-5-methylphenyl)acetamide |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C27 H27 N3 O2 S |
| Smiles: | Cc1ccc(c(c1)NC(CSC1CC(c2ccccc2)=Nc2cc(C)c(C)cc2N=1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.3592 |
| logD: | 5.3533 |
| logSw: | -5.3868 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.271 |
| InChI Key: | KGXOGZNIGZKVQI-UHFFFAOYSA-N |