1-(2-chloro-6-fluorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Chemical Structure Depiction of
1-(2-chloro-6-fluorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
1-(2-chloro-6-fluorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide
Compound characteristics
| Compound ID: | V002-8427 |
| Compound Name: | 1-(2-chloro-6-fluorophenyl)-N-(3-cyanophenyl)-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carboxamide |
| Molecular Weight: | 465.91 |
| Molecular Formula: | C25 H21 Cl F N3 O3 |
| Smiles: | COc1cc2CCN(C(c2cc1OC)c1c(cccc1[Cl])F)C(Nc1cccc(C#N)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6217 |
| logD: | 4.6217 |
| logSw: | -4.811 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.999 |
| InChI Key: | OPYJDBBTCUUCOP-DEOSSOPVSA-N |