3-{[(chloroacetyl)(cyclopropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(chloroacetyl)(cyclopropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[(chloroacetyl)(cyclopropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
Compound ID: | V006-5660 |
Compound Name: | 3-{[(chloroacetyl)(cyclopropyl)amino]methyl}phenyl 4-fluorobenzene-1-sulfonate |
Molecular Weight: | 397.85 |
Molecular Formula: | C18 H17 Cl F N O4 S |
Smiles: | C1CC1N(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(C[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.2019 |
logD: | 3.2019 |
logSw: | -3.3261 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 51.259 |
InChI Key: | KQCUAXHAPMWCQN-UHFFFAOYSA-N |