2-(4-methoxyphenyl)-1-oxo-N-[4-(piperidine-1-sulfonyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-methoxyphenyl)-1-oxo-N-[4-(piperidine-1-sulfonyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
2-(4-methoxyphenyl)-1-oxo-N-[4-(piperidine-1-sulfonyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1631 |
| Compound Name: | 2-(4-methoxyphenyl)-1-oxo-N-[4-(piperidine-1-sulfonyl)phenyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 517.6 |
| Molecular Formula: | C28 H27 N3 O5 S |
| Smiles: | COc1ccc(cc1)N1C=C(C(Nc2ccc(cc2)S(N2CCCCC2)(=O)=O)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.622 |
| logD: | 3.5813 |
| logSw: | -3.918 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.1 |
| InChI Key: | UQXUMKWPPWIKNI-UHFFFAOYSA-N |