4-({3-methoxy-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
4-({3-methoxy-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl methanesulfonate
4-({3-methoxy-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V011-3779 |
| Compound Name: | 4-({3-methoxy-N-[(oxolan-2-yl)methyl]benzamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C21 H25 N O6 S |
| Smiles: | COc1cccc(c1)C(N(CC1CCCO1)Cc1ccc(cc1)OS(C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0591 |
| logD: | 2.0591 |
| logSw: | -2.6653 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.525 |
| InChI Key: | LZAIHXCSIFBGJQ-HXUWFJFHSA-N |