3-[2-(3,4-diethoxyphenyl)ethyl]-N-(3-ethoxyphenyl)-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
3-[2-(3,4-diethoxyphenyl)ethyl]-N-(3-ethoxyphenyl)-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
3-[2-(3,4-diethoxyphenyl)ethyl]-N-(3-ethoxyphenyl)-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide
Compound characteristics
| Compound ID: | 8012-5789 |
| Compound Name: | 3-[2-(3,4-diethoxyphenyl)ethyl]-N-(3-ethoxyphenyl)-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide |
| Molecular Weight: | 579.69 |
| Molecular Formula: | C31 H34 F N3 O5 S |
| Smiles: | CCOc1cccc(c1)NC(C1CC(N(CCc2ccc(c(c2)OCC)OCC)/C(=N/c2ccc(cc2)F)S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3087 |
| logD: | 5.3086 |
| logSw: | -5.2517 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.661 |
| InChI Key: | DELICRFPZVPZAR-NDEPHWFRSA-N |