4-chloro-2-{[N-(cyclopropylmethyl)-3-fluorobenzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[N-(cyclopropylmethyl)-3-fluorobenzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-chloro-2-{[N-(cyclopropylmethyl)-3-fluorobenzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-9523 |
| Compound Name: | 4-chloro-2-{[N-(cyclopropylmethyl)-3-fluorobenzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 491.94 |
| Molecular Formula: | C24 H20 Cl F2 N O4 S |
| Smiles: | C1CC1CN(Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4156 |
| logD: | 5.4156 |
| logSw: | -6.0248 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.549 |
| InChI Key: | KVZKCVLJCCDPPU-UHFFFAOYSA-N |