1-[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]-N-ethyl-N-(3-methylphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]-N-ethyl-N-(3-methylphenyl)piperidine-4-carboxamide
1-[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]-N-ethyl-N-(3-methylphenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | F533-0486 |
| Compound Name: | 1-[2,5-dimethyl-4-(piperidine-1-carbonyl)-1H-pyrrole-3-sulfonyl]-N-ethyl-N-(3-methylphenyl)piperidine-4-carboxamide |
| Molecular Weight: | 514.69 |
| Molecular Formula: | C27 H38 N4 O4 S |
| Smiles: | CCN(C(C1CCN(CC1)S(c1c(C(N2CCCCC2)=O)c(C)[nH]c1C)(=O)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5502 |
| logD: | 3.5502 |
| logSw: | -3.7455 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.733 |
| InChI Key: | KJSMFCNCIOLNNZ-UHFFFAOYSA-N |