4-({[2-(dimethylamino)ethyl](4-methylbenzene-1-sulfonyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-({[2-(dimethylamino)ethyl](4-methylbenzene-1-sulfonyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
4-({[2-(dimethylamino)ethyl](4-methylbenzene-1-sulfonyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V013-1832 |
| Compound Name: | 4-({[2-(dimethylamino)ethyl](4-methylbenzene-1-sulfonyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 506.61 |
| Molecular Formula: | C24 H27 F N2 O5 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)S(N(CCN(C)C)Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3564 |
| logD: | 3.8111 |
| logSw: | -4.176 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 71.219 |
| InChI Key: | JISHZXSUUSQZLN-UHFFFAOYSA-N |