N-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C033-0431 |
| Compound Name: | N-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 459.48 |
| Molecular Formula: | C26 H22 F N3 O4 |
| Smiles: | Cc1ccc(cc1F)NC(CNC(C1=CN(C(c2ccccc12)=O)c1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6063 |
| logD: | 3.6062 |
| logSw: | -3.8834 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.647 |
| InChI Key: | MGDPXLWOKRDIPL-UHFFFAOYSA-N |