4-chloro-2-({(cyclobutanecarbonyl)[2-(dimethylamino)ethyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-({(cyclobutanecarbonyl)[2-(dimethylamino)ethyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
4-chloro-2-({(cyclobutanecarbonyl)[2-(dimethylamino)ethyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-9036 |
| Compound Name: | 4-chloro-2-({(cyclobutanecarbonyl)[2-(dimethylamino)ethyl]amino}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 468.97 |
| Molecular Formula: | C22 H26 Cl F N2 O4 S |
| Smiles: | CN(C)CCN(Cc1cc(ccc1OS(c1ccc(cc1)F)(=O)=O)[Cl])C(C1CCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6864 |
| logD: | 2.7223 |
| logSw: | -4.0868 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.665 |
| InChI Key: | YEYHASGCCOAQRD-UHFFFAOYSA-N |