2-[(2-chloro-N-cyclopropylbenzamido)methyl]-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Chemical Structure Depiction of
2-[(2-chloro-N-cyclopropylbenzamido)methyl]-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
2-[(2-chloro-N-cyclopropylbenzamido)methyl]-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-2661 |
| Compound Name: | 2-[(2-chloro-N-cyclopropylbenzamido)methyl]-5-(diethylamino)phenyl 3-(trifluoromethyl)benzene-1-sulfonate |
| Molecular Weight: | 581.05 |
| Molecular Formula: | C28 H28 Cl F3 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(C2CC2)C(c2ccccc2[Cl])=O)c(c1)OS(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5598 |
| logD: | 6.5491 |
| logSw: | -6.085 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.338 |
| InChI Key: | LQRKZOOLXVICBE-UHFFFAOYSA-N |