ethyl 8-methyl-6-(4-{[4-(trifluoromethyl)phenyl]carbamamido}phenyl)-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Chemical Structure Depiction of
ethyl 8-methyl-6-(4-{[4-(trifluoromethyl)phenyl]carbamamido}phenyl)-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
ethyl 8-methyl-6-(4-{[4-(trifluoromethyl)phenyl]carbamamido}phenyl)-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Compound characteristics
| Compound ID: | V031-0470 |
| Compound Name: | ethyl 8-methyl-6-(4-{[4-(trifluoromethyl)phenyl]carbamamido}phenyl)-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate |
| Molecular Weight: | 518.56 |
| Molecular Formula: | C25 H25 F3 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCOC(C1C(c2ccc(cc2)NC(Nc2ccc(cc2)C(F)(F)F)=O)N2CCCSC2=NC=1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8026 |
| logD: | 5.3112 |
| logSw: | -5.4638 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.225 |
| InChI Key: | ZMLGAYFUCDIALG-OAQYLSRUSA-N |