N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C033-0501 |
| Compound Name: | N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 487.51 |
| Molecular Formula: | C27 H25 N3 O6 |
| Smiles: | COc1ccc(c(c1)NC(CNC(C1=CN(C(c2ccccc12)=O)c1ccccc1OC)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.64 |
| logD: | 2.6398 |
| logSw: | -3.4243 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.123 |
| InChI Key: | XTWPWKSOFLSIEY-UHFFFAOYSA-N |