3-{[(diphenylacetyl)(propan-2-yl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
3-{[(diphenylacetyl)(propan-2-yl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
3-{[(diphenylacetyl)(propan-2-yl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-5038 |
| Compound Name: | 3-{[(diphenylacetyl)(propan-2-yl)amino]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 567.63 |
| Molecular Formula: | C31 H28 F3 N O4 S |
| Smiles: | CC(C)N(Cc1cccc(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)C(C(c1ccccc1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9359 |
| logD: | 6.9359 |
| logSw: | -5.8108 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.683 |
| InChI Key: | IVQYVYJZJURLNZ-UHFFFAOYSA-N |