2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)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-dihydro-1,4-benzodioxin-6-yl)acetamide
2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Compound characteristics
| Compound ID: | F402-0183 |
| Compound Name: | 2-[4-(5-bromothiophen-2-yl)-2-oxo-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide |
| Molecular Weight: | 512.38 |
| Molecular Formula: | C23 H18 Br N3 O4 S |
| Smiles: | C1C(c2ccc(s2)[Br])=Nc2ccccc2N(CC(Nc2ccc3c(c2)OCCO3)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.7337 |
| logD: | 3.7337 |
| logSw: | -4.1007 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.581 |
| InChI Key: | ZMVGZFRISDAFGK-UHFFFAOYSA-N |