4-chloro-2-{[2-chloro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[2-chloro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-chloro-2-{[2-chloro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-3580 |
| Compound Name: | 4-chloro-2-{[2-chloro-N-(2-methylpropyl)benzamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 510.41 |
| Molecular Formula: | C24 H22 Cl2 F N O4 S |
| Smiles: | CC(C)CN(Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1056 |
| logD: | 6.1056 |
| logSw: | -5.8905 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.298 |
| InChI Key: | ONPQADYIVNDGOI-UHFFFAOYSA-N |