ethyl 2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-5-(3-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-5-(3-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-5-(3-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2388-1169 |
| Compound Name: | ethyl 2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-5-(3-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 501.92 |
| Molecular Formula: | C23 H17 Cl F N3 O5 S |
| Smiles: | CCOC(C1C(c2cccc(c2)[N+]([O-])=O)N2C(=NC=1C)SC(=C/c1c(cccc1[Cl])F)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7888 |
| logD: | 4.7888 |
| logSw: | -5.0547 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.129 |
| InChI Key: | GSHFCIRHKMUXQO-FQEVSTJZSA-N |