2-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-1076 |
| Compound Name: | 2-{[(cyclobutanecarbonyl)(propan-2-yl)amino]methyl}-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 526.62 |
| Molecular Formula: | C26 H33 F3 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(C(C)C)C(C2CCC2)=O)c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4585 |
| logD: | 5.4478 |
| logSw: | -5.461 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.301 |
| InChI Key: | BKUCKWRQPCURFJ-UHFFFAOYSA-N |