N-(4-bromo-3-methylphenyl)-2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
N-(4-bromo-3-methylphenyl)-2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide
Compound characteristics
| Compound ID: | F402-0227 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]acetamide |
| Molecular Weight: | 547.27 |
| Molecular Formula: | C22 H17 Br2 N3 O2 S |
| Smiles: | Cc1cc(ccc1[Br])NC(CN1C(CC(c2ccc(s2)[Br])=Nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9357 |
| logD: | 5.9356 |
| logSw: | -5.417 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.758 |
| InChI Key: | XHNBTVXWMCNTDQ-UHFFFAOYSA-N |