2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C033-0447 |
| Compound Name: | 2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 517.54 |
| Molecular Formula: | C28 H27 N3 O7 |
| Smiles: | COc1ccccc1N1C=C(C(NCC(Nc2cc(c(c(c2)OC)OC)OC)=O)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.3371 |
| logD: | 2.337 |
| logSw: | -3.1974 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.624 |
| InChI Key: | XYSNPJQKEYOUHD-UHFFFAOYSA-N |