N-(2-methoxy-5-nitrophenyl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-nitrophenyl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(2-methoxy-5-nitrophenyl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | K936-0303 |
| Compound Name: | N-(2-methoxy-5-nitrophenyl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 445.43 |
| Molecular Formula: | C24 H19 N3 O6 |
| Smiles: | COc1ccc(cc1)N1C=C(C(Nc2cc(ccc2OC)[N+]([O-])=O)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.3144 |
| logD: | 2.6032 |
| logSw: | -3.8715 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.703 |
| InChI Key: | CBXFIXHEAPLBJC-UHFFFAOYSA-N |