methyl 4-(N-benzoyl-N-cyclohexylglycyl)-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-(N-benzoyl-N-cyclohexylglycyl)-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-(N-benzoyl-N-cyclohexylglycyl)-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
Compound ID: | V005-4286 |
Compound Name: | methyl 4-(N-benzoyl-N-cyclohexylglycyl)-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
Molecular Weight: | 410.51 |
Molecular Formula: | C24 H30 N2 O4 |
Smiles: | Cc1c(C(CN(C2CCCCC2)C(c2ccccc2)=O)=O)c(C)n(C)c1C(=O)OC |
Stereo: | ACHIRAL |
logP: | 3.7611 |
logD: | 3.7611 |
logSw: | -4.1773 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.652 |
InChI Key: | BJIGIVUJQAQFGB-UHFFFAOYSA-N |