2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(5-chloro-2-methoxyphenyl)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-methoxyphenyl)acetamide
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(5-chloro-2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F402-0199 |
| Compound Name: | 2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(5-chloro-2-methoxyphenyl)acetamide |
| Molecular Weight: | 518.82 |
| Molecular Formula: | C22 H17 Br Cl N3 O3 S |
| Smiles: | COc1ccc(cc1NC(CN1C(CC(c2ccc(s2)[Br])=Nc2ccccc12)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.014 |
| logD: | 5.007 |
| logSw: | -4.9904 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.69 |
| InChI Key: | XKFNXNFGUHWJBQ-UHFFFAOYSA-N |