5-({[(benzyloxy)acetyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
5-({[(benzyloxy)acetyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
5-({[(benzyloxy)acetyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-5085 |
| Compound Name: | 5-({[(benzyloxy)acetyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 551.58 |
| Molecular Formula: | C27 H28 F3 N O6 S |
| Smiles: | CC(C)N(Cc1ccc(c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O)OC)C(COCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8691 |
| logD: | 4.8691 |
| logSw: | -4.801 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.579 |
| InChI Key: | HNUWNMDCSZSGKT-UHFFFAOYSA-N |