1-(4-chlorophenyl)-6,7-dimethoxy-2-(4-nitrophenyl)-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-6,7-dimethoxy-2-(4-nitrophenyl)-1,4-dihydroisoquinolin-3(2H)-one
1-(4-chlorophenyl)-6,7-dimethoxy-2-(4-nitrophenyl)-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | D145-0141 |
| Compound Name: | 1-(4-chlorophenyl)-6,7-dimethoxy-2-(4-nitrophenyl)-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 438.87 |
| Molecular Formula: | C23 H19 Cl N2 O5 |
| Smiles: | COc1cc2CC(N(C(c3ccc(cc3)[Cl])c2cc1OC)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5018 |
| logD: | 4.5018 |
| logSw: | -5.0827 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.96 |
| InChI Key: | ZXKGLZKSPCVKDX-QHCPKHFHSA-N |