1-[2-(4-bromoanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
1-[2-(4-bromoanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
1-[2-(4-bromoanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
Compound ID: | J078-0675 |
Compound Name: | 1-[2-(4-bromoanilino)-2-oxoethyl]-N,N-diethyl-2-oxo-1,2-dihydroquinoline-4-carboxamide |
Molecular Weight: | 456.34 |
Molecular Formula: | C22 H22 Br N3 O3 |
Smiles: | CCN(CC)C(C1=CC(N(CC(Nc2ccc(cc2)[Br])=O)c2ccccc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1567 |
logD: | 3.1566 |
logSw: | -3.6798 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.7 |
InChI Key: | LUUQBOAIGHFHJD-UHFFFAOYSA-N |