1-[2-(3-bromoanilino)-2-oxoethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
1-[2-(3-bromoanilino)-2-oxoethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
1-[2-(3-bromoanilino)-2-oxoethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
| Compound ID: | J078-1148 |
| Compound Name: | 1-[2-(3-bromoanilino)-2-oxoethyl]-N-methyl-2-oxo-1,2-dihydroquinoline-4-carboxamide |
| Molecular Weight: | 414.26 |
| Molecular Formula: | C19 H16 Br N3 O3 |
| Smiles: | CNC(C1=CC(N(CC(Nc2cccc(c2)[Br])=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2373 |
| logD: | 2.2371 |
| logSw: | -3.1322 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.604 |
| InChI Key: | BGLNBQORSDNTOX-UHFFFAOYSA-N |