ethyl {1-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]cyclohexyl}acetate
Chemical Structure Depiction of
ethyl {1-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]cyclohexyl}acetate
ethyl {1-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]cyclohexyl}acetate
Compound characteristics
Compound ID: | G331-0629 |
Compound Name: | ethyl {1-[({1-[(4-chlorophenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]cyclohexyl}acetate |
Molecular Weight: | 431.96 |
Molecular Formula: | C23 H30 Cl N3 O3 |
Smiles: | CCOC(CC1(CCCCC1)NC(NCc1cccn1Cc1ccc(cc1)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 4.3798 |
logD: | 4.3798 |
logSw: | -4.5138 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.457 |
InChI Key: | OPSATWAATVLUQC-UHFFFAOYSA-N |