1-[2-(3-cyanoanilino)-2-oxoethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
1-[2-(3-cyanoanilino)-2-oxoethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
1-[2-(3-cyanoanilino)-2-oxoethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
| Compound ID: | J078-1191 |
| Compound Name: | 1-[2-(3-cyanoanilino)-2-oxoethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide |
| Molecular Weight: | 360.37 |
| Molecular Formula: | C20 H16 N4 O3 |
| Smiles: | CNC(C1=CC(N(CC(Nc2cccc(C#N)c2)=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2902 |
| logD: | 1.29 |
| logSw: | -2.5604 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.66 |
| InChI Key: | DVOBJLHQBBVKTF-UHFFFAOYSA-N |