ethyl 4-{3-[(3-cyanophenyl)carbamoyl]piperidine-1-sulfonyl}-1-ethyl-2,5-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-[(3-cyanophenyl)carbamoyl]piperidine-1-sulfonyl}-1-ethyl-2,5-dimethyl-1H-pyrrole-3-carboxylate
ethyl 4-{3-[(3-cyanophenyl)carbamoyl]piperidine-1-sulfonyl}-1-ethyl-2,5-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G937-2106 |
| Compound Name: | ethyl 4-{3-[(3-cyanophenyl)carbamoyl]piperidine-1-sulfonyl}-1-ethyl-2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C24 H30 N4 O5 S |
| Smiles: | CCn1c(C)c(C(=O)OCC)c(c1C)S(N1CCCC(C1)C(Nc1cccc(C#N)c1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3442 |
| logD: | 2.3417 |
| logSw: | -2.956 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.478 |
| InChI Key: | KQHNYVHNLXCDTQ-IBGZPJMESA-N |