ethyl 5-{[N-cyclohexyl(3-methylbutyl)carbamamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{[N-cyclohexyl(3-methylbutyl)carbamamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-{[N-cyclohexyl(3-methylbutyl)carbamamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F346-0306 |
| Compound Name: | ethyl 5-{[N-cyclohexyl(3-methylbutyl)carbamamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 391.55 |
| Molecular Formula: | C22 H37 N3 O3 |
| Smiles: | CCOC(c1c(C)c(CN(C2CCCCC2)C(NCCC(C)C)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0666 |
| logD: | 5.0666 |
| logSw: | -4.4642 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.909 |
| InChI Key: | QZJVSDKBMFAYTC-UHFFFAOYSA-N |