methyl 2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2388-1181 |
| Compound Name: | methyl 2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 573.09 |
| Molecular Formula: | C29 H21 Cl N4 O3 S2 |
| Smiles: | CC1=C(C(c2cccs2)N2C(=N1)SC(=C/c1cn(c3ccccc3)nc1c1ccc(cc1)[Cl])\C2=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8567 |
| logD: | 5.8567 |
| logSw: | -6.1163 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.819 |
| InChI Key: | FUWUCZKBXFKMCV-SANMLTNESA-N |