N-[3-(methylsulfanyl)phenyl]-2-[2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-[2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
N-[3-(methylsulfanyl)phenyl]-2-[2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
Compound characteristics
| Compound ID: | F402-0067 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-[2-oxo-4-(thiophen-2-yl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C22 H19 N3 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(CN1C(CC(c2cccs2)=Nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3486 |
| logD: | 4.3486 |
| logSw: | -4.3439 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.758 |
| InChI Key: | WDQXLIOADRCELK-UHFFFAOYSA-N |