2-{[N-(butan-2-yl)-2-chlorobenzamido]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[N-(butan-2-yl)-2-chlorobenzamido]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
2-{[N-(butan-2-yl)-2-chlorobenzamido]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-2726 |
| Compound Name: | 2-{[N-(butan-2-yl)-2-chlorobenzamido]methyl}-4-chlorophenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 510.41 |
| Molecular Formula: | C24 H22 Cl2 F N O4 S |
| Smiles: | CCC(C)N(Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])C(c1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2795 |
| logD: | 6.2795 |
| logSw: | -5.9706 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.626 |
| InChI Key: | XRCFFQVQQRMIJH-INIZCTEOSA-N |