2-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
2-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-2702 |
| Compound Name: | 2-{[(butan-2-yl)(methoxyacetyl)amino]methyl}-5-(diethylamino)phenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 531.5 |
| Molecular Formula: | C24 H32 Cl2 N2 O5 S |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1ccc(cc1OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)N(CC)CC)C(COC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4293 |
| logD: | 5.4186 |
| logSw: | -5.972 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.53 |
| InChI Key: | BETUVEJDAFWNRP-KRWDZBQOSA-N |