N-{3-[ethyl(phenyl)amino]propyl}-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[ethyl(phenyl)amino]propyl}-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-{3-[ethyl(phenyl)amino]propyl}-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C096-0823 |
| Compound Name: | N-{3-[ethyl(phenyl)amino]propyl}-3-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 503.62 |
| Molecular Formula: | C30 H34 F N3 O3 |
| Smiles: | CCN(CCCNC(C1C(c2ccc(cc2)F)N(CCOC)C(c2ccccc12)=O)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3148 |
| logD: | 4.2857 |
| logSw: | -4.1993 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.488 |
| InChI Key: | NSEDWHZEQABDRP-UHFFFAOYSA-N |