4-chloro-2-({(methoxyacetyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-({(methoxyacetyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-({(methoxyacetyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-3600 |
| Compound Name: | 4-chloro-2-({(methoxyacetyl)[(oxolan-2-yl)methyl]amino}methyl)phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 510.99 |
| Molecular Formula: | C23 H27 Cl N2 O7 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(CC1CCCO1)C(COC)=O)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9188 |
| logD: | 1.9187 |
| logSw: | -3.0219 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.11 |
| InChI Key: | XVPDFINFBITWRQ-HXUWFJFHSA-N |