2-methoxy-5-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-methoxy-5-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-2936 |
| Compound Name: | 2-methoxy-5-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 530.56 |
| Molecular Formula: | C24 H29 F3 N2 O6 S |
| Smiles: | CC(C)NC(N(CC1CCCO1)Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7532 |
| logD: | 3.7532 |
| logSw: | -4.0339 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.7 |
| InChI Key: | CXPYBGSBJYZESY-LJQANCHMSA-N |