ethyl 3-{2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate

Chemical Structure Depiction of
ethyl 3-{2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Available: 54 mg
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mg
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Compound characteristics

Compound ID: M183-0743
Compound Name: ethyl 3-{2-[4-(azepan-1-yl)-1-oxophthalazin-2(1H)-yl]acetamido}benzoate
Molecular Weight: 448.52
Molecular Formula: C25 H28 N4 O4
Smiles: CCOC(c1cccc(c1)NC(CN1C(c2ccccc2C(=N1)N1CCCCCC1)=O)=O)=O
Stereo: ACHIRAL
logP: 4.3907
logD: 4.3907
logSw: -4.0825
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 74.471
InChI Key: AXLDTESYXZZOTD-UHFFFAOYSA-N
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