2-{[(cyclobutanecarbonyl)(2-methylpropyl)amino]methyl}-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-{[(cyclobutanecarbonyl)(2-methylpropyl)amino]methyl}-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-{[(cyclobutanecarbonyl)(2-methylpropyl)amino]methyl}-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-8427 |
| Compound Name: | 2-{[(cyclobutanecarbonyl)(2-methylpropyl)amino]methyl}-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 540.65 |
| Molecular Formula: | C27 H35 F3 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(CC(C)C)C(C2CCC2)=O)c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8682 |
| logD: | 5.8575 |
| logSw: | -5.5525 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.557 |
| InChI Key: | IDVVALXDWFWXLW-UHFFFAOYSA-N |