2,2,2-trifluoro-1-[3-(4-methylbenzene-1-sulfonyl)-2-phenyl-1,3-diazinan-1-yl]ethan-1-one
Chemical Structure Depiction of
2,2,2-trifluoro-1-[3-(4-methylbenzene-1-sulfonyl)-2-phenyl-1,3-diazinan-1-yl]ethan-1-one
2,2,2-trifluoro-1-[3-(4-methylbenzene-1-sulfonyl)-2-phenyl-1,3-diazinan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | 7673-0010 |
| Compound Name: | 2,2,2-trifluoro-1-[3-(4-methylbenzene-1-sulfonyl)-2-phenyl-1,3-diazinan-1-yl]ethan-1-one |
| Molecular Weight: | 412.43 |
| Molecular Formula: | C19 H19 F3 N2 O3 S |
| Smiles: | Cc1ccc(cc1)S(N1CCCN(C1c1ccccc1)C(C(F)(F)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9222 |
| logD: | 3.9222 |
| logSw: | -3.7968 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.324 |
| InChI Key: | GJXBSQNZAUMBMC-KRWDZBQOSA-N |