ethyl 4-({N-cyclohexyl[(4-fluorophenyl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-({N-cyclohexyl[(4-fluorophenyl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-({N-cyclohexyl[(4-fluorophenyl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
Compound ID: | G799-0298 |
Compound Name: | ethyl 4-({N-cyclohexyl[(4-fluorophenyl)methyl]carbamamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
Molecular Weight: | 429.53 |
Molecular Formula: | C24 H32 F N3 O3 |
Smiles: | CCOC(c1c(C)c(CN(C2CCCCC2)C(NCc2ccc(cc2)F)=O)c(C)[nH]1)=O |
Stereo: | ACHIRAL |
logP: | 4.907 |
logD: | 4.907 |
logSw: | -4.464 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.301 |
InChI Key: | HHTTUJYSIWQSNV-UHFFFAOYSA-N |