prop-2-en-1-yl 2-[(2,4-dichlorophenyl)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
prop-2-en-1-yl 2-[(2,4-dichlorophenyl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 2-[(2,4-dichlorophenyl)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: | Y070-1003 |
| Compound Name: | prop-2-en-1-yl 2-[(2,4-dichlorophenyl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 491.41 |
| Molecular Formula: | C22 H16 Cl2 N2 O3 S2 |
| Smiles: | CC1=C(C(c2cccs2)N2C(=N1)SC(=C\c1ccc(cc1[Cl])[Cl])\C2=O)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5544 |
| logD: | 5.5544 |
| logSw: | -5.9177 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.06 |
| InChI Key: | LEDMHNGTUJKBJS-IBGZPJMESA-N |