ethyl 2-[(3,5-dichloro-2-hydroxyphenyl)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
ethyl 2-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(3,5-dichloro-2-hydroxyphenyl)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: | 8008-9794 |
Compound Name: | ethyl 2-[(3,5-dichloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
Molecular Weight: | 495.4 |
Molecular Formula: | C21 H16 Cl2 N2 O4 S2 |
Smiles: | CCOC(C1C(c2cccs2)N2C(=NC=1C)SC(=C\c1cc(cc(c1O)[Cl])[Cl])\C2=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.2917 |
logD: | 4.8432 |
logSw: | -5.3919 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.245 |
InChI Key: | ZFSSEWGJMYXACM-KRWDZBQOSA-N |