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89587-05-3

89587-05-3 | 1H-Pyrido[3,4-b]indol-1-one, 2,3,4,9-tetrahydro-9-phenyl-

CAS No: 89587-05-3 Catalog No: AG003Z3W MDL No:

Product Description

Catalog Number:
AG003Z3W
Chemical Name:
1H-Pyrido[3,4-b]indol-1-one, 2,3,4,9-tetrahydro-9-phenyl-
CAS Number:
89587-05-3
Molecular Formula:
C17H14N2O
Molecular Weight:
262.3059
IUPAC Name:
9-phenyl-3,4-dihydro-2H-pyrido[3,4-b]indol-1-one
InChI:
InChI=1S/C17H14N2O/c20-17-16-14(10-11-18-17)13-8-4-5-9-15(13)19(16)12-6-2-1-3-7-12/h1-9H,10-11H2,(H,18,20)
InChI Key:
PCJXMUSJCHDMRS-UHFFFAOYSA-N
SMILES:
O=C1NCCc2c1n(c1ccccc1)c1c2cccc1

Properties

Complexity:
377  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.111g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
262.312g/mol
Monoisotopic Mass:
262.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
34A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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