ethyl 7-methyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-methyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 7-methyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | 4489-4335 |
Compound Name: | ethyl 7-methyl-2-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
Molecular Weight: | 557.63 |
Molecular Formula: | C30 H27 N3 O6 S |
Smiles: | CCOC(C1C(c2ccc(cc2)C(C)C)N2C(=NC=1C)SC(=C/c1ccc(c3ccccc3[N+]([O-])=O)o1)\C2=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.6235 |
logD: | 6.6235 |
logSw: | -5.7795 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 86.398 |
InChI Key: | KSJSHCABMFLGNC-HHHXNRCGSA-N |