2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F402-0194 |
| Compound Name: | 2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(5-chloro-2,4-dimethoxyphenyl)acetamide |
| Molecular Weight: | 548.84 |
| Molecular Formula: | C23 H19 Br Cl N3 O4 S |
| Smiles: | COc1cc(c(cc1NC(CN1C(CC(c2ccc(s2)[Br])=Nc2ccccc12)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.06 |
| logD: | 5.0452 |
| logSw: | -5.305 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.321 |
| InChI Key: | CJQIYMYTSHKAOK-UHFFFAOYSA-N |