1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-3-carboxamide
Chemical Structure Depiction of
1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-3-carboxamide
1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F602-0212 |
| Compound Name: | 1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-N-{[4-(methylsulfanyl)phenyl]methyl}piperidine-3-carboxamide |
| Molecular Weight: | 385.53 |
| Molecular Formula: | C21 H27 N3 O2 S |
| Smiles: | [H]c1c(C)c(C(N2CCCC(C2)C(NCc2ccc(cc2)SC)=O)=O)[nH]c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7499 |
| logD: | 2.7499 |
| logSw: | -3.1302 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.444 |
| InChI Key: | MLHPXJNXBSVORD-KRWDZBQOSA-N |