prop-2-en-1-yl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V020-0663 |
| Compound Name: | prop-2-en-1-yl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-methyl-5-[4-(propan-2-yl)phenyl]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 522.67 |
| Molecular Formula: | C28 H34 N4 O4 S |
| Smiles: | CC(C)c1ccc(cc1)C1C(=C(C)N=C2N1C(CC(N1CCN(CC1)C(C)=O)=O)=CS2)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6848 |
| logD: | 3.6846 |
| logSw: | -3.8851 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.021 |
| InChI Key: | JHMBQHCIKRTHNO-AREMUKBSSA-N |