N-[(4-chlorophenyl)methyl]-3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
N-[(4-chlorophenyl)methyl]-3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | F379-0819 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 423.96 |
| Molecular Formula: | C20 H26 Cl N3 O3 S |
| Smiles: | CC1CCN(CC1)S(c1c(C)c(C(NCc2ccc(cc2)[Cl])=O)[nH]c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5287 |
| logD: | 3.5285 |
| logSw: | -3.9989 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.344 |
| InChI Key: | XEYZSJBENJWEKA-UHFFFAOYSA-N |