ethyl 2-{[2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carbonyl]amino}benzoate
ethyl 2-{[2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | E456-2120 |
| Compound Name: | ethyl 2-{[2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carbonyl]amino}benzoate |
| Molecular Weight: | 442.47 |
| Molecular Formula: | C26 H22 N2 O5 |
| Smiles: | CCOC(c1ccccc1NC(C1=CN(C(c2ccccc12)=O)c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1878 |
| logD: | 3.6008 |
| logSw: | -4.3147 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.445 |
| InChI Key: | JCMZSRYSEBDZBZ-UHFFFAOYSA-N |