ethyl 4-{[(butan-2-yl)-N-cyclohexylcarbamamido]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-{[(butan-2-yl)-N-cyclohexylcarbamamido]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-{[(butan-2-yl)-N-cyclohexylcarbamamido]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G799-0305 |
| Compound Name: | ethyl 4-{[(butan-2-yl)-N-cyclohexylcarbamamido]methyl}-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 377.53 |
| Molecular Formula: | C21 H35 N3 O3 |
| Smiles: | CCC(C)NC(N(Cc1c(C)c(C(=O)OCC)[nH]c1C)C1CCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6707 |
| logD: | 4.6707 |
| logSw: | -4.2096 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.014 |
| InChI Key: | NYYDKQNJZDOFRL-AWEZNQCLSA-N |