2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(3-methylbutyl)acetamide
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | F402-0213 |
| Compound Name: | 2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 448.38 |
| Molecular Formula: | C20 H22 Br N3 O2 S |
| Smiles: | CC(C)CCNC(CN1C(CC(c2ccc(s2)[Br])=Nc2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2066 |
| logD: | 4.2065 |
| logSw: | -4.0852 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.193 |
| InChI Key: | FENKZRIKQBQHFS-UHFFFAOYSA-N |