4-{[N-cyclopropyl(propan-2-yl)carbamamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
4-{[N-cyclopropyl(propan-2-yl)carbamamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
4-{[N-cyclopropyl(propan-2-yl)carbamamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-9238 |
| Compound Name: | 4-{[N-cyclopropyl(propan-2-yl)carbamamido]methyl}phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 456.48 |
| Molecular Formula: | C21 H23 F3 N2 O4 S |
| Smiles: | CC(C)NC(N(Cc1ccc(cc1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5696 |
| logD: | 4.5696 |
| logSw: | -4.3788 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.904 |
| InChI Key: | UWOBOEBLRGLJAE-UHFFFAOYSA-N |