3-({(methoxyacetyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
3-({(methoxyacetyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
3-({(methoxyacetyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-1584 |
| Compound Name: | 3-({(methoxyacetyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 467.97 |
| Molecular Formula: | C22 H26 Cl N O6 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1cccc(CN(CC2CCCO2)C(COC)=O)c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5335 |
| logD: | 2.5335 |
| logSw: | -3.1023 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.762 |
| InChI Key: | VOAQBKZGXYFXGQ-LJQANCHMSA-N |