N-[2-(4-chlorophenyl)ethyl]-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(4-chlorophenyl)ethyl]-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1509 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 432.91 |
| Molecular Formula: | C25 H21 Cl N2 O3 |
| Smiles: | COc1ccc(cc1)N1C=C(C(NCCc2ccc(cc2)[Cl])=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.6221 |
| logD: | 3.6221 |
| logSw: | -4.1743 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.553 |
| InChI Key: | SPIOAWZXWZAMQQ-UHFFFAOYSA-N |