ethyl 6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E749-0053 |
| Compound Name: | ethyl 6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C22 H25 F N4 O3 S |
| Smiles: | CCOC(C1C(c2cccs2)NC(NC=1CN1CCN(CC1)c1ccccc1F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6646 |
| logD: | 2.6646 |
| logSw: | -3.091 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.762 |
| InChI Key: | IXBDCALHSQALDB-FQEVSTJZSA-N |