methyl 7-methyl-3-{2-oxo-2-[(prop-2-en-1-yl)amino]ethyl}-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-methyl-3-{2-oxo-2-[(prop-2-en-1-yl)amino]ethyl}-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 7-methyl-3-{2-oxo-2-[(prop-2-en-1-yl)amino]ethyl}-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V012-0890 |
| Compound Name: | methyl 7-methyl-3-{2-oxo-2-[(prop-2-en-1-yl)amino]ethyl}-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C23 H27 N3 O3 S |
| Smiles: | CC(C)c1ccc(cc1)C1C(=C(C)N=C2N1C(CC(NCC=C)=O)=CS2)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6688 |
| logD: | 3.6682 |
| logSw: | -3.872 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.143 |
| InChI Key: | MVCUWPAYAFPGSS-OAQYLSRUSA-N |