ethyl 4-(2,5-dimethylphenyl)-6-{[4-(ethylcarbamoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2,5-dimethylphenyl)-6-{[4-(ethylcarbamoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2,5-dimethylphenyl)-6-{[4-(ethylcarbamoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V014-5964 |
| Compound Name: | ethyl 4-(2,5-dimethylphenyl)-6-{[4-(ethylcarbamoyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 471.6 |
| Molecular Formula: | C25 H37 N5 O4 |
| Salt: | not_available |
| Smiles: | CCNC(N1CCN(CC1C)CC1=C(C(c2cc(C)ccc2C)NC(N1C)=O)C(=O)OCC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8357 |
| logD: | 0.6687 |
| logSw: | -2.9534 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.237 |
| InChI Key: | XGKVOTPJQHSUAU-UHFFFAOYSA-N |