N-(3,5-dimethylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-(3,5-dimethylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | L389-0011 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 441.59 |
| Molecular Formula: | C27 H27 N3 O S |
| Smiles: | Cc1cc(C)cc(c1)NC(CSC1CC(c2ccccc2)=Nc2cc(C)c(C)cc2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2153 |
| logD: | 6.2094 |
| logSw: | -5.5038 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.339 |
| InChI Key: | SQBMPCYNUSKGJQ-UHFFFAOYSA-N |