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Home > Pyridines > 102267-86-7
102267-86-7 | 5H-Pyrrolo[3,4-b]pyridine-5,7(6H)-dione, 6-phenyl-3-propyl-
CAS No: 102267-86-7 Catalog No: AG000721 MDL No:
Product Description
Catalog Number:
AG000721
Chemical Name:
5H-Pyrrolo[3,4-b]pyridine-5,7(6H)-dione, 6-phenyl-3-propyl-
CAS Number:
102267-86-7
Molecular Formula:
C16H14N2O2
Molecular Weight:
266.2946
IUPAC Name:
6-phenyl-3-propylpyrrolo[3,4-b]pyridine-5,7-dione
InChI:
InChI=1S/C16H14N2O2/c1-2-6-11-9-13-14(17-10-11)16(20)18(15(13)19)12-7-4-3-5-8-12/h3-5,7-10H,2,6H2,1H3
InChI Key:
WPDXBQPTDAHUBM-UHFFFAOYSA-N
SMILES:
CCCc1cnc2c(c1)C(=O)N(C2=O)c1ccccc1
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.106g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.3g/mol
Monoisotopic Mass:
266.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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