N-(4-bromophenyl)-2-{[3-cyano-4-(2-methylpropyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-{[3-cyano-4-(2-methylpropyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
N-(4-bromophenyl)-2-{[3-cyano-4-(2-methylpropyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 1085-1033 |
| Compound Name: | N-(4-bromophenyl)-2-{[3-cyano-4-(2-methylpropyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 458.42 |
| Molecular Formula: | C22 H24 Br N3 O S |
| Smiles: | CC(C)Cc1c2CCCCc2nc(c1C#N)SCC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.3919 |
| logD: | 6.3918 |
| logSw: | -5.6278 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.341 |
| InChI Key: | HYZXOCCUJZLBAO-UHFFFAOYSA-N |