N-(2,6-dichlorophenyl)-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
N-(2,6-dichlorophenyl)-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
N-(2,6-dichlorophenyl)-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8013-0559 |
| Compound Name: | N-(2,6-dichlorophenyl)-2-(4-fluorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 479.36 |
| Molecular Formula: | C22 H17 Cl2 F N2 O3 S |
| Smiles: | C1C(C(Nc2c(cccc2[Cl])[Cl])=O)N(Cc2ccccc12)S(c1ccc(cc1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6777 |
| logD: | 4.4957 |
| logSw: | -5.9426 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.778 |
| InChI Key: | VDWVTEWOYYIPOG-FQEVSTJZSA-N |