ethyl 6-{[4-(tert-butylcarbamoyl)piperazin-1-yl]methyl}-4-(4-tert-butylphenyl)-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-{[4-(tert-butylcarbamoyl)piperazin-1-yl]methyl}-4-(4-tert-butylphenyl)-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-{[4-(tert-butylcarbamoyl)piperazin-1-yl]methyl}-4-(4-tert-butylphenyl)-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V003-0532 |
| Compound Name: | ethyl 6-{[4-(tert-butylcarbamoyl)piperazin-1-yl]methyl}-4-(4-tert-butylphenyl)-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 513.68 |
| Molecular Formula: | C28 H43 N5 O4 |
| Smiles: | CCOC(C1C(c2ccc(cc2)C(C)(C)C)NC(N(C)C=1CN1CCN(CC1)C(NC(C)(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.043 |
| logD: | 1.8514 |
| logSw: | -3.8443 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.217 |
| InChI Key: | KLZNMXFTPMXZAO-QHCPKHFHSA-N |