ethyl 1-ethyl-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 1-ethyl-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | V020-1590 |
| Compound Name: | ethyl 1-ethyl-6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C29 H37 F N4 O3 |
| Salt: | not_available |
| Smiles: | CCN1C(CN2CCN(CC2)c2ccccc2F)=C(C(c2ccc(cc2)C(C)C)NC1=O)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1591 |
| logD: | 4.3455 |
| logSw: | -4.9693 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.441 |
| InChI Key: | ZFEFBZJUSVWJTE-HHHXNRCGSA-N |