4-({N-[2-(dimethylamino)ethyl](4-methylphenyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-({N-[2-(dimethylamino)ethyl](4-methylphenyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
4-({N-[2-(dimethylamino)ethyl](4-methylphenyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-4271 |
| Compound Name: | 4-({N-[2-(dimethylamino)ethyl](4-methylphenyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 485.58 |
| Molecular Formula: | C25 H28 F N3 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC(N(CCN(C)C)Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3623 |
| logD: | 2.2206 |
| logSw: | -4.1066 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.876 |
| InChI Key: | RAZCNCSMZZLJEA-UHFFFAOYSA-N |