methyl 4-[N-cyclohexyl-N-(4-methylbenzene-1-sulfonyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[N-cyclohexyl-N-(4-methylbenzene-1-sulfonyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[N-cyclohexyl-N-(4-methylbenzene-1-sulfonyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-7178 |
| Compound Name: | methyl 4-[N-cyclohexyl-N-(4-methylbenzene-1-sulfonyl)glycyl]-1-ethyl-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 474.62 |
| Molecular Formula: | C25 H34 N2 O5 S |
| Smiles: | CCn1c(C)c(C(CN(C2CCCCC2)S(c2ccc(C)cc2)(=O)=O)=O)c(C)c1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.8661 |
| logD: | 4.8661 |
| logSw: | -4.6763 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.769 |
| InChI Key: | XCEDCYZAYIOGMG-UHFFFAOYSA-N |