2-(7-chloro-3-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-(7-chloro-3-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-[3-(methylsulfanyl)phenyl]acetamide
2-(7-chloro-3-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C386-0458 |
| Compound Name: | 2-(7-chloro-3-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 463.98 |
| Molecular Formula: | C25 H22 Cl N3 O2 S |
| Smiles: | CC1C(N(CC(Nc2cccc(c2)SC)=O)c2ccc(cc2C(c2ccccc2)=N1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6077 |
| logD: | 4.6077 |
| logSw: | -4.685 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.87 |
| InChI Key: | NHYMVFSYCAQICH-MRXNPFEDSA-N |