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10261-82-2,MFCD11877925
Catalog No.:AA0007U1
10261-82-2 | 1,5-Naphthyridin-2(1H)-one
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100mg
97%
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$55.00   $39.00
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1g
95%
in stock  
$321.00   $225.00
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  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0007U1
Chemical Name:
1,5-Naphthyridin-2(1H)-one
CAS Number:
10261-82-2
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
MDL Number:
MFCD11877925
IUPAC Name:
1H-1,5-naphthyridin-2-one
InChI:
InChI=1S/C8H6N2O/c11-8-4-3-6-7(10-8)2-1-5-9-6/h1-5H,(H,10,11)
InChI Key:
OJFSCKNLUYOABN-UHFFFAOYSA-N
SMILES:
O=c1ccc2c([nH]1)cccn2
Properties
Computed Properties
 
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.149g/mol
Monoisotopic Mass:
146.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

Synonyms
 
1,5-Naphthyridin-2(1H)-one 
10261-82-2 
SCHEMBL276404 
[1,5]Naphthyridin-2-ol # 
CTK0H1738 
KS-00000OBF 
DTXSID60343425 
ANW-57285 
MFCD11877925 
ZINC14982949 
1,2-dihydro-1,5-naphthyridin-2-one 
AKOS006305289 
1,5-NAPHTHYRIDIN-2-OL 
AKOS016001473 
CM10314 
FCH1191904 
AJ-65764 
DS-13190 
AX8208229 
DB-081952 
4CH-002743 
AM20050621 
CS-0039082 
2-Hydroxy-1,5-naphthyridine 
FT-0752810 
ST24026787 
16742-EP2315767A2 
261H822 
A800590 
F2147-5475 
[1,5]Naphthyridin-2-ol 
CID589680 
23616-31-1 
1H-1,5-naphthyridin-2-one 
OJFSCKNLUYOABN-UHFFFAOYSA-N 
AK-38086 
1,5-naphthyridinone 
AC1LBVEW 
PYRIDINO-PYRIDINONE 
Literature

Title: High-Dimensional descriptor selection and computational QSAR modeling for antitumor activity of ARC-111 analogues Based on Support Vector Regression (SVR).

Journal: International journal of molecular sciences 20120101

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