ethyl 4-(2-methylphenyl)-6-[(3-methyl-4-propanoylpiperazin-1-yl)methyl]-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-methylphenyl)-6-[(3-methyl-4-propanoylpiperazin-1-yl)methyl]-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2-methylphenyl)-6-[(3-methyl-4-propanoylpiperazin-1-yl)methyl]-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V015-0779 |
| Compound Name: | ethyl 4-(2-methylphenyl)-6-[(3-methyl-4-propanoylpiperazin-1-yl)methyl]-2-oxo-1-(prop-2-en-1-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 468.6 |
| Molecular Formula: | C26 H36 N4 O4 |
| Salt: | not_available |
| Smiles: | CCC(N1CCN(CC1C)CC1=C(C(c2ccccc2C)NC(N1CC=C)=O)C(=O)OCC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2138 |
| logD: | 2.6362 |
| logSw: | -3.1901 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.154 |
| InChI Key: | LLQPUMFQZCDEJL-UHFFFAOYSA-N |