N-(2,6-dimethylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
N-(2,6-dimethylphenyl)-2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | L389-0049 |
| Compound Name: | N-(2,6-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: | Cc1cc2c(cc1C)N=C(CC(c1ccccc1)=N2)SCC(Nc1c(C)cccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.707 |
| logD: | 5.7011 |
| logSw: | -5.4786 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.943 |
| InChI Key: | CFFSBNYCRHDMRI-UHFFFAOYSA-N |