2-(4-bromophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-bromophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide
2-(4-bromophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y503-0574 |
| Compound Name: | 2-(4-bromophenyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide |
| Molecular Weight: | 488.4 |
| Molecular Formula: | C25 H18 Br N3 O S |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(c1cc(c3ccc(cc3)[Br])nc3ccccc13)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 7.0457 |
| logD: | 6.0905 |
| logSw: | -6.3164 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.16 |
| InChI Key: | RKXCGSFPOUFOSK-UHFFFAOYSA-N |