4-({[2-(dimethylamino)ethyl][(4-fluorophenyl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-({[2-(dimethylamino)ethyl][(4-fluorophenyl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
4-({[2-(dimethylamino)ethyl][(4-fluorophenyl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V012-0195 |
| Compound Name: | 4-({[2-(dimethylamino)ethyl][(4-fluorophenyl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 488.55 |
| Molecular Formula: | C25 H26 F2 N2 O4 S |
| Smiles: | CN(C)CCN(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)C(Cc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9537 |
| logD: | 3.0031 |
| logSw: | -3.9105 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.528 |
| InChI Key: | MWNLCXRLHWZKQZ-UHFFFAOYSA-N |