4-chloro-2-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-3609 |
| Compound Name: | 4-chloro-2-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 480.97 |
| Molecular Formula: | C22 H25 Cl N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(CC1CC1)C(COC)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7457 |
| logD: | 2.7456 |
| logSw: | -3.535 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.979 |
| InChI Key: | XBNHKOIOKBEUBY-UHFFFAOYSA-N |