2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | F402-0205 |
| Compound Name: | 2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 542.45 |
| Molecular Formula: | C25 H24 Br N3 O4 S |
| Smiles: | COc1ccc(CCNC(CN2C(CC(c3ccc(s3)[Br])=Nc3ccccc23)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.6307 |
| logD: | 3.6307 |
| logSw: | -4.0151 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.182 |
| InChI Key: | XAXOHZYOFRLHIO-UHFFFAOYSA-N |