2-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
2-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-6261 |
| Compound Name: | 2-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 450.53 |
| Molecular Formula: | C22 H27 F N2 O5 S |
| Smiles: | CC(C)NC(N(CC1CCCO1)Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6017 |
| logD: | 3.6017 |
| logSw: | -3.8214 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.069 |
| InChI Key: | OWGQGVFTDVKOMD-LJQANCHMSA-N |