N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C033-0449 |
| Compound Name: | N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 521.96 |
| Molecular Formula: | C27 H24 Cl N3 O6 |
| Smiles: | COc1cc(c(cc1NC(CNC(C1=CN(C(c2ccccc12)=O)c1ccccc1OC)=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 3.2554 |
| logD: | 3.2521 |
| logSw: | -3.6938 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.21 |
| InChI Key: | UTHIHMONZLKZPW-UHFFFAOYSA-N |