ethyl 4-(4-tert-butylphenyl)-1-ethyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-tert-butylphenyl)-1-ethyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(4-tert-butylphenyl)-1-ethyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V001-0934 |
| Compound Name: | ethyl 4-(4-tert-butylphenyl)-1-ethyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 527.71 |
| Molecular Formula: | C29 H45 N5 O4 |
| Smiles: | CCCNC(N1CCN(CC1C)CC1=C(C(c2ccc(cc2)C(C)(C)C)NC(N1CC)=O)C(=O)OCC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8705 |
| logD: | 2.8299 |
| logSw: | -4.3028 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.412 |
| InChI Key: | UUPRMPNANMRVKW-UHFFFAOYSA-N |