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131185-06-3

131185-06-3 | 3(2H)-Pyridazinone, 6-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-

CAS No: 131185-06-3 Catalog No: AG000VO1 MDL No:

Product Description

Catalog Number:
AG000VO1
Chemical Name:
3(2H)-Pyridazinone, 6-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-
CAS Number:
131185-06-3
Molecular Formula:
C17H12N4O
Molecular Weight:
288.3034
IUPAC Name:
3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-1H-pyridazin-6-one
InChI:
InChI=1S/C17H12N4O/c22-15-10-9-13(18-19-15)16-14-8-4-5-11-21(14)20-17(16)12-6-2-1-3-7-12/h1-11H,(H,19,22)
InChI Key:
MBCUSHSOCQIFLW-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)c1c(nn2c1cccc2)c1ccccc1

Properties

Complexity:
495  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.101g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
288.31g/mol
Monoisotopic Mass:
288.101g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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