3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-N-(4-propoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxamide
Chemical Structure Depiction of
3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-N-(4-propoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxamide
3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-N-(4-propoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxamide
Compound characteristics
| Compound ID: | 2743-1111 |
| Compound Name: | 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-N-(4-propoxyphenyl)-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazinane-6-carboxamide |
| Molecular Weight: | 615.67 |
| Molecular Formula: | C31 H32 F3 N3 O5 S |
| Smiles: | CCCOc1ccc(cc1)NC(C1CC(N(CCc2ccc(c(c2)OC)OC)/C(=N/c2cccc(c2)C(F)(F)F)S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.3303 |
| logD: | 6.3298 |
| logSw: | -5.564 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.796 |
| InChI Key: | IUEZLCVTYUBOCK-MHZLTWQESA-N |