methyl 2-[(3-chloro-4-fluorophenyl)imino]-3-[2-(3,4-diethoxyphenyl)ethyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
Chemical Structure Depiction of
methyl 2-[(3-chloro-4-fluorophenyl)imino]-3-[2-(3,4-diethoxyphenyl)ethyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
methyl 2-[(3-chloro-4-fluorophenyl)imino]-3-[2-(3,4-diethoxyphenyl)ethyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate
Compound characteristics
| Compound ID: | C636-2221 |
| Compound Name: | methyl 2-[(3-chloro-4-fluorophenyl)imino]-3-[2-(3,4-diethoxyphenyl)ethyl]-4-oxo-3,4-dihydro-2H-1,3-thiazine-6-carboxylate |
| Molecular Weight: | 506.98 |
| Molecular Formula: | C24 H24 Cl F N2 O5 S |
| Smiles: | CCOc1ccc(CCN2/C(=N/c3ccc(c(c3)[Cl])F)SC(=CC2=O)C(=O)OC)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.6457 |
| logD: | 4.6457 |
| logSw: | -4.8782 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.62 |
| InChI Key: | MDPZPXNJMNCROL-UHFFFAOYSA-N |