N-(4-chloro-2-fluorophenyl)-5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluorobenzamide
N-(4-chloro-2-fluorophenyl)-5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | K781-8134 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluorobenzamide |
| Molecular Weight: | 462.9 |
| Molecular Formula: | C22 H17 Cl F2 N2 O3 S |
| Smiles: | C1CN(Cc2ccccc12)S(c1ccc(c(c1)C(Nc1ccc(cc1F)[Cl])=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3095 |
| logD: | 3.8255 |
| logSw: | -5.8397 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.005 |
| InChI Key: | SICHASNZXGFFDF-UHFFFAOYSA-N |