4-chloro-2-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-chloro-2-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-9535 |
| Compound Name: | 4-chloro-2-{[(cyclopropylmethyl)(methoxyacetyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 441.9 |
| Molecular Formula: | C20 H21 Cl F N O5 S |
| Smiles: | COCC(N(CC1CC1)Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5736 |
| logD: | 3.5736 |
| logSw: | -3.9269 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.717 |
| InChI Key: | QJXYADKUBLTPSQ-UHFFFAOYSA-N |