propan-2-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
propan-2-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
propan-2-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V004-5539 |
| Compound Name: | propan-2-yl 3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-7-methyl-5-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 547.57 |
| Molecular Formula: | C27 H25 F4 N3 O3 S |
| Smiles: | CC(C)OC(C1C(c2ccc(cc2)C(F)(F)F)N2C(CC(NCc3ccc(cc3)F)=O)=CSC2=NC=1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3838 |
| logD: | 5.3814 |
| logSw: | -5.4237 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.289 |
| InChI Key: | JPYYMQVRLWQEAP-XMMPIXPASA-N |