ethyl 6-{[4-(tert-butylcarbamoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-{[4-(tert-butylcarbamoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-{[4-(tert-butylcarbamoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | V016-9114 |
Compound Name: | ethyl 6-{[4-(tert-butylcarbamoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 471.6 |
Molecular Formula: | C25 H37 N5 O4 |
Salt: | not_available |
Smiles: | CCOC(C1C(c2ccccc2)NC(N(C)C=1CN1CCN(C(C)C1)C(NC(C)(C)C)=O)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.6988 |
logD: | 0.5318 |
logSw: | -2.9401 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.435 |
InChI Key: | CKENTDCBWVIUNT-UHFFFAOYSA-N |