2-({2-methyl-N-[(oxolan-2-yl)methyl]propanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-({2-methyl-N-[(oxolan-2-yl)methyl]propanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
2-({2-methyl-N-[(oxolan-2-yl)methyl]propanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V031-1972 |
| Compound Name: | 2-({2-methyl-N-[(oxolan-2-yl)methyl]propanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 435.51 |
| Molecular Formula: | C22 H26 F N O5 S |
| Smiles: | CC(C)C(N(CC1CCCO1)Cc1ccccc1OS(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6174 |
| logD: | 3.6174 |
| logSw: | -3.7609 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.952 |
| InChI Key: | ARWGAILXOHQFNZ-LJQANCHMSA-N |