ethyl 6-[(4-benzoyl-3-methylpiperazin-1-yl)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-[(4-benzoyl-3-methylpiperazin-1-yl)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-[(4-benzoyl-3-methylpiperazin-1-yl)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V020-0983 |
| Compound Name: | ethyl 6-[(4-benzoyl-3-methylpiperazin-1-yl)methyl]-1-methyl-2-oxo-4-(3-phenoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 568.67 |
| Molecular Formula: | C33 H36 N4 O5 |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2cccc(c2)Oc2ccccc2)NC(N(C)C=1CN1CCN(C(C)C1)C(c1ccccc1)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5011 |
| logD: | 3.9869 |
| logSw: | -4.2097 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.945 |
| InChI Key: | POLKIRUAUIUNML-UHFFFAOYSA-N |