rel-(5aR,9aS)-7-[(4-methoxyphenyl)methyl]-1-methyl-4-[(pyridin-3-yl)methyl]octahydro-1H-pyrido[4,3-e][1,4]diazepine-2,5-dione

Chemical Structure Depiction of
rel-(5aR,9aS)-7-[(4-methoxyphenyl)methyl]-1-methyl-4-[(pyridin-3-yl)methyl]octahydro-1H-pyrido[4,3-e][1,4]diazepine-2,5-dione
Available: 2 mg
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mg
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Compound characteristics

Compound ID: SD14-0631
Compound Name: rel-(5aR,9aS)-7-[(4-methoxyphenyl)methyl]-1-methyl-4-[(pyridin-3-yl)methyl]octahydro-1H-pyrido[4,3-e][1,4]diazepine-2,5-dione
Molecular Weight: 408.5
Molecular Formula: C23 H28 N4 O3
Smiles: CN1C(CN(Cc2cccnc2)C([C@H]2CN(CC[C@@H]12)Cc1ccc(cc1)OC)=O)=O
Stereo: RACEMIC MIXTURE (RELATIVE)
logP: 0.3062
logD: -0.0148
logSw: -1.1096
Hydrogen bond acceptors count: 7
Polar surface area: 53.428
InChI Key: CZOZVRFFELZBCZ-RTWAWAEBSA-N
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