N-[(4-ethoxyphenyl)methyl]-3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
N-[(4-ethoxyphenyl)methyl]-3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | F379-0678 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-3,5-dimethyl-4-(piperidine-1-sulfonyl)-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 419.54 |
| Molecular Formula: | C21 H29 N3 O4 S |
| Smiles: | CCOc1ccc(CNC(c2c(C)c(c(C)[nH]2)S(N2CCCCC2)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8289 |
| logD: | 2.8289 |
| logSw: | -3.2892 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.468 |
| InChI Key: | BOCIIUJSFPGFPH-UHFFFAOYSA-N |