11-[2-[4-[4-(diethylamino)butyl]piperidin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one


Chemical Name: 11-[2-[4-[4-(diethylamino)butyl]piperidin-1-yl]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
CAS Number: 123548-16-3
Product Number: AG000KSC(AGN-PC-0JMLZD)
Synonyms:
MDL No: MFCD00884623
Molecular Formula: C27H37N5O2
Molecular Weight: 463.6150

Identification/Properties


Computed Properties
Molecular Weight:
463.626g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
9
Exact Mass:
463.295g/mol
Monoisotopic Mass:
463.295g/mol
Topological Polar Surface Area:
68.8A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
661
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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