N-(4-bromophenyl)-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
N-(4-bromophenyl)-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D360-7009 |
| Compound Name: | N-(4-bromophenyl)-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 416.29 |
| Molecular Formula: | C18 H14 Br N3 O2 S |
| Smiles: | C1CC(c2cc(C#N)c(nc2C1)SCC(Nc1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.096 |
| logD: | 4.0959 |
| logSw: | -4.3178 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.589 |
| InChI Key: | JCIOBRYJIAMVLP-UHFFFAOYSA-N |