ethyl 4-(2,5-dimethylphenyl)-1-methyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2,5-dimethylphenyl)-1-methyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2,5-dimethylphenyl)-1-methyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V016-3805 |
| Compound Name: | ethyl 4-(2,5-dimethylphenyl)-1-methyl-6-{[3-methyl-4-(propylcarbamoyl)piperazin-1-yl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 485.63 |
| Molecular Formula: | C26 H39 N5 O4 |
| Smiles: | CCCNC(N1CCN(CC1C)CC1=C(C(c2cc(C)ccc2C)NC(N1C)=O)C(=O)OCC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5454 |
| logD: | 1.3784 |
| logSw: | -3.4761 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.453 |
| InChI Key: | KEEONGOKMGOTQL-UHFFFAOYSA-N |