2,2,2-trifluoro-1-[2-(4-methoxyphenyl)-3-(4-methylbenzene-1-sulfonyl)-1,3-diazinan-1-yl]ethan-1-one
Chemical Structure Depiction of
2,2,2-trifluoro-1-[2-(4-methoxyphenyl)-3-(4-methylbenzene-1-sulfonyl)-1,3-diazinan-1-yl]ethan-1-one
2,2,2-trifluoro-1-[2-(4-methoxyphenyl)-3-(4-methylbenzene-1-sulfonyl)-1,3-diazinan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 7673-0019 |
| Compound Name: | 2,2,2-trifluoro-1-[2-(4-methoxyphenyl)-3-(4-methylbenzene-1-sulfonyl)-1,3-diazinan-1-yl]ethan-1-one |
| Molecular Weight: | 442.46 |
| Molecular Formula: | C20 H21 F3 N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(N1CCCN(C1c1ccc(cc1)OC)C(C(F)(F)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9003 |
| logD: | 3.9003 |
| logSw: | -3.9236 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.867 |
| InChI Key: | NEXRCUZRMCCMMB-SFHVURJKSA-N |