3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
Compound characteristics
| Compound ID: | 2742-4802 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-fluorophenyl)-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide |
| Molecular Weight: | 525.57 |
| Molecular Formula: | C27 H25 F2 N3 O4 S |
| Smiles: | COc1ccc(CCN2/C(=N/c3ccc(cc3)F)SC(CC2=O)C(Nc2ccc(cc2)F)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3926 |
| logD: | 4.3923 |
| logSw: | -4.2876 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.378 |
| InChI Key: | CTCRLQVPWNMDAB-DEOSSOPVSA-N |