4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide
4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V016-9335 |
| Compound Name: | 4-[1-(3,4-dimethoxyphenyl)-2-methyl-5-phenyl-1H-pyrrole-3-carbonyl]-N-[4-(methylsulfanyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 570.71 |
| Molecular Formula: | C32 H34 N4 O4 S |
| Smiles: | Cc1c(cc(c2ccccc2)n1c1ccc(c(c1)OC)OC)C(N1CCN(CC1)C(Nc1ccc(cc1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3622 |
| logD: | 5.3622 |
| logSw: | -5.4496 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.847 |
| InChI Key: | LCIMDYXIGVFCDL-UHFFFAOYSA-N |