4-({[2-(dimethylamino)ethyl][(thiophen-2-yl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-({[2-(dimethylamino)ethyl][(thiophen-2-yl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
4-({[2-(dimethylamino)ethyl][(thiophen-2-yl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-4046 |
| Compound Name: | 4-({[2-(dimethylamino)ethyl][(thiophen-2-yl)acetyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 476.59 |
| Molecular Formula: | C23 H25 F N2 O4 S2 |
| Smiles: | CN(C)CCN(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)C(Cc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4758 |
| logD: | 2.5253 |
| logSw: | -3.6843 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.546 |
| InChI Key: | AYQPOOJLLRTNHY-UHFFFAOYSA-N |