2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)-4-chlorophenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)-4-chlorophenyl 4-fluorobenzene-1-sulfonate
2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)-4-chlorophenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-4716 |
| Compound Name: | 2-({acetyl[(4-fluorophenyl)methyl]amino}methyl)-4-chlorophenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 465.9 |
| Molecular Formula: | C22 H18 Cl F2 N O4 S |
| Smiles: | CC(N(Cc1ccc(cc1)F)Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5722 |
| logD: | 4.5722 |
| logSw: | -4.685 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.765 |
| InChI Key: | GZEMUKCXHAFPBF-UHFFFAOYSA-N |