2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-[(3-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-[(3-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | L389-0067 |
| Compound Name: | 2-[(7,8-dimethyl-4-phenyl-3H-1,5-benzodiazepin-2-yl)sulfanyl]-N-[(3-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 457.59 |
| Molecular Formula: | C27 H27 N3 O2 S |
| Smiles: | Cc1cc2c(cc1C)N=C(CC(c1ccccc1)=N2)SCC(NCc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3009 |
| logD: | 5.1932 |
| logSw: | -5.3767 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.205 |
| InChI Key: | HWXJGLVVGPVFIN-UHFFFAOYSA-N |