methyl 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
methyl 8-methyl-6-(4-{[4-(trifluoromethyl)phenyl]carbamamido}phenyl)-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
methyl 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: | V026-5129 |
| Compound Name: | methyl 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: | 504.53 |
| Molecular Formula: | C24 H23 F3 N4 O3 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(c2ccc(cc2)NC(Nc2ccc(cc2)C(F)(F)F)=O)N2CCCSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3621 |
| logD: | 5.0502 |
| logSw: | -5.3222 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.646 |
| InChI Key: | WHPUYLUSHOPLFK-HXUWFJFHSA-N |