N-{3-[butyl(ethyl)amino]propyl}-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[butyl(ethyl)amino]propyl}-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-{3-[butyl(ethyl)amino]propyl}-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1552 |
| Compound Name: | N-{3-[butyl(ethyl)amino]propyl}-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C26 H33 N3 O3 |
| Smiles: | CCCCN(CC)CCCNC(C1=CN(C(c2ccccc12)=O)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2534 |
| logD: | 0.5608 |
| logSw: | -3.6346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.489 |
| InChI Key: | HPFRIFSWFSFWPI-UHFFFAOYSA-N |