2-[(3-chlorophenyl)imino]-3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
2-[(3-chlorophenyl)imino]-3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
2-[(3-chlorophenyl)imino]-3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
Compound characteristics
Compound ID: | 4514-1752 |
Compound Name: | 2-[(3-chlorophenyl)imino]-3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide |
Molecular Weight: | 542.03 |
Molecular Formula: | C27 H25 Cl F N3 O4 S |
Smiles: | COc1ccc(CCN2/C(=N/c3cccc(c3)[Cl])SC(CC2=O)C(Nc2ccc(cc2)F)=O)cc1OC |
Stereo: | RACEMIC MIXTURE |
logP: | 5.1829 |
logD: | 5.1827 |
logSw: | -5.4413 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.378 |
InChI Key: | KBHSKCDMSCTWKD-DEOSSOPVSA-N |