4-({(2-methoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl propane-2-sulfonate
Chemical Structure Depiction of
4-({(2-methoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl propane-2-sulfonate
4-({(2-methoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V023-9639 |
| Compound Name: | 4-({(2-methoxyphenyl)-N-[(oxolan-2-yl)methyl]carbamamido}methyl)phenyl propane-2-sulfonate |
| Molecular Weight: | 462.56 |
| Molecular Formula: | C23 H30 N2 O6 S |
| Smiles: | CC(C)S(=O)(=O)Oc1ccc(CN(CC2CCCO2)C(Nc2ccccc2OC)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3912 |
| logD: | 3.3912 |
| logSw: | -3.8432 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.619 |
| InChI Key: | SUIVOWDAIUBMEU-HXUWFJFHSA-N |