dimethyl 7-{2-[(2-chlorophenyl)methoxy]-5-nitrophenyl}-2-oxo-3,7-dihydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylate
Chemical Structure Depiction of
dimethyl 7-{2-[(2-chlorophenyl)methoxy]-5-nitrophenyl}-2-oxo-3,7-dihydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylate
dimethyl 7-{2-[(2-chlorophenyl)methoxy]-5-nitrophenyl}-2-oxo-3,7-dihydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylate
Compound characteristics
| Compound ID: | 6193-0987 |
| Compound Name: | dimethyl 7-{2-[(2-chlorophenyl)methoxy]-5-nitrophenyl}-2-oxo-3,7-dihydro-2H-thiopyrano[2,3-d][1,3]thiazole-5,6-dicarboxylate |
| Molecular Weight: | 548.98 |
| Molecular Formula: | C23 H17 Cl N2 O8 S2 |
| Smiles: | COC(C1C(C2=C(NC(=O)S2)SC=1C(=O)OC)c1cc(ccc1OCc1ccccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.471 |
| logD: | 5.4651 |
| logSw: | -5.9289 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.265 |
| InChI Key: | GIGXJMCVWGFMDW-INIZCTEOSA-N |