ethyl 5-(4-chlorophenyl)-7-methyl-2-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-chlorophenyl)-7-methyl-2-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(4-chlorophenyl)-7-methyl-2-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | 2031-0068 |
Compound Name: | ethyl 5-(4-chlorophenyl)-7-methyl-2-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
Molecular Weight: | 549.99 |
Molecular Formula: | C27 H20 Cl N3 O6 S |
Smiles: | CCOC(C1C(c2ccc(cc2)[Cl])N2C(=NC=1C)SC(=C/c1ccc(c3cccc(c3)[N+]([O-])=O)o1)\C2=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.2408 |
logD: | 6.2408 |
logSw: | -6.3034 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 86.699 |
InChI Key: | WYNZAPUDSRRVEM-DEOSSOPVSA-N |