ethyl 1-ethyl-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-ethyl-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V018-7084 |
| Compound Name: | ethyl 1-ethyl-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-4-[4-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 454.49 |
| Molecular Formula: | C22 H29 F3 N4 O3 |
| Smiles: | CCN1C(CN2CCN(C)CC2)=C(C(c2ccc(cc2)C(F)(F)F)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.698 |
| logD: | 0.8327 |
| logSw: | -2.864 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.958 |
| InChI Key: | BHYVRJHPCBIQJM-IBGZPJMESA-N |