4-{[cyclopropyl(methoxyacetyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-{[cyclopropyl(methoxyacetyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-{[cyclopropyl(methoxyacetyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-3936 |
| Compound Name: | 4-{[cyclopropyl(methoxyacetyl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 423.91 |
| Molecular Formula: | C20 H22 Cl N O5 S |
| Smiles: | Cc1cccc(c1S(=O)(=O)Oc1ccc(CN(C2CC2)C(COC)=O)cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2277 |
| logD: | 3.2277 |
| logSw: | -3.4018 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.683 |
| InChI Key: | ZWXBEYZDEJVILN-UHFFFAOYSA-N |