ethyl 2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y501-4559 |
| Compound Name: | ethyl 2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 519.02 |
| Molecular Formula: | C27 H23 Cl N4 O3 S |
| Smiles: | CCOC(C1C(c2ccccc2)N2C(=NC=1C)SC(=C/c1c(C)nn(c3ccccc3)c1[Cl])\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9517 |
| logD: | 4.9517 |
| logSw: | -4.9926 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.547 |
| InChI Key: | JUUZGGXITYBHHA-QHCPKHFHSA-N |