N-(2-bromophenyl)-1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1-benzothiophene-2-carbonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2-bromophenyl)-1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1-benzothiophene-2-carbonyl]piperidine-4-carboxamide
N-(2-bromophenyl)-1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1-benzothiophene-2-carbonyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C795-0971 |
| Compound Name: | N-(2-bromophenyl)-1-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1-benzothiophene-2-carbonyl]piperidine-4-carboxamide |
| Molecular Weight: | 536.49 |
| Molecular Formula: | C27 H26 Br N3 O2 S |
| Smiles: | Cc1cc(C)c2c(c(C(N3CCC(CC3)C(Nc3ccccc3[Br])=O)=O)sc2c1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1199 |
| logD: | 6.1198 |
| logSw: | -5.6608 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.411 |
| InChI Key: | GZWBYYWDZJUWNM-UHFFFAOYSA-N |