ethyl 1-(2-bromo-11-oxo-11H-pyrido[2,1-b]quinazoline-6-carbonyl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-bromo-11-oxo-11H-pyrido[2,1-b]quinazoline-6-carbonyl)piperidine-4-carboxylate
ethyl 1-(2-bromo-11-oxo-11H-pyrido[2,1-b]quinazoline-6-carbonyl)piperidine-4-carboxylate
Compound characteristics
Compound ID: | K306-0608 |
Compound Name: | ethyl 1-(2-bromo-11-oxo-11H-pyrido[2,1-b]quinazoline-6-carbonyl)piperidine-4-carboxylate |
Molecular Weight: | 458.31 |
Molecular Formula: | C21 H20 Br N3 O4 |
Smiles: | CCOC(C1CCN(CC1)C(C1=CC=CN2C1=Nc1ccc(cc1C2=O)[Br])=O)=O |
Stereo: | ACHIRAL |
logP: | 2.5348 |
logD: | 2.5348 |
logSw: | -2.8706 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 61.907 |
InChI Key: | PVSYGUJALWQVQJ-UHFFFAOYSA-N |