ethyl 6-({4-[(3-chlorophenyl)methyl]piperazin-1-yl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-({4-[(3-chlorophenyl)methyl]piperazin-1-yl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-({4-[(3-chlorophenyl)methyl]piperazin-1-yl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | Y503-4075 |
Compound Name: | ethyl 6-({4-[(3-chlorophenyl)methyl]piperazin-1-yl}methyl)-1-ethyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 497.04 |
Molecular Formula: | C27 H33 Cl N4 O3 |
Smiles: | CCN1C(CN2CCN(CC2)Cc2cccc(c2)[Cl])=C(C(c2ccccc2)NC1=O)C(=O)OCC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9832 |
logD: | 2.5363 |
logSw: | -4.2223 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.022 |
InChI Key: | UIGRGQJIAIEKQJ-RUZDIDTESA-N |