ethyl N-(5-ethyl-12-oxo-5,5a,6,7,8,9,10,12-octahydroazepino[2,1-b]quinazoline-3-carbonyl)-beta-alaninate

Chemical Structure Depiction of
ethyl N-(5-ethyl-12-oxo-5,5a,6,7,8,9,10,12-octahydroazepino[2,1-b]quinazoline-3-carbonyl)-beta-alaninate
Available: 120 mg
Amount:
mg
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Compound characteristics

Compound ID: S413-0542
Compound Name: ethyl N-(5-ethyl-12-oxo-5,5a,6,7,8,9,10,12-octahydroazepino[2,1-b]quinazoline-3-carbonyl)-beta-alaninate
Molecular Weight: 387.48
Molecular Formula: C21 H29 N3 O4
Smiles: CCN1C2CCCCCN2C(c2ccc(cc12)C(NCCC(=O)OCC)=O)=O
Stereo: RACEMIC MIXTURE
logP: 2.1698
logD: 2.1698
logSw: -2.9307
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 63.263
InChI Key: ADJNGAMENMJURL-SFHVURJKSA-N
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