N-[3-(2-ethoxyanilino)-3-oxopropyl]-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(2-ethoxyanilino)-3-oxopropyl]-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[3-(2-ethoxyanilino)-3-oxopropyl]-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C033-0240 |
| Compound Name: | N-[3-(2-ethoxyanilino)-3-oxopropyl]-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 485.54 |
| Molecular Formula: | C28 H27 N3 O5 |
| Smiles: | CCOc1ccccc1NC(CCNC(C1=CN(C(c2ccccc12)=O)c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8576 |
| logD: | 2.8575 |
| logSw: | -3.5822 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.215 |
| InChI Key: | RWRUDBMBRNUQKF-UHFFFAOYSA-N |