2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | F402-0206 |
| Compound Name: | 2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 500.43 |
| Molecular Formula: | C22 H18 Br N3 O2 S2 |
| Smiles: | CSc1cccc(c1)NC(CN1C(CC(c2ccc(s2)[Br])=Nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2221 |
| logD: | 5.2221 |
| logSw: | -5.0012 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.758 |
| InChI Key: | AYKBVFZXMCHHLZ-UHFFFAOYSA-N |