methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-ethyl-5-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-ethyl-5-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-ethyl-5-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V025-8038 |
| Compound Name: | methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-ethyl-5-[4-(trifluoromethyl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 536.57 |
| Molecular Formula: | C25 H27 F3 N4 O4 S |
| Smiles: | CCC1=C(C(c2ccc(cc2)C(F)(F)F)N2C(CC(N3CCN(CC3)C(C)=O)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2425 |
| logD: | 3.241 |
| logSw: | -3.2042 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.754 |
| InChI Key: | JNTRITHNLBOSNL-JOCHJYFZSA-N |