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919485-94-2

919485-94-2 | 5-Pyrimidinecarboxaldehyde, 4-amino-6-[(6-fluoro-1H-indol-5-yl)oxy]-

CAS No: 919485-94-2 Catalog No: AG006640 MDL No:

Product Description

Catalog Number:
AG006640
Chemical Name:
5-Pyrimidinecarboxaldehyde, 4-amino-6-[(6-fluoro-1H-indol-5-yl)oxy]-
CAS Number:
919485-94-2
Molecular Formula:
C13H9FN4O2
Molecular Weight:
272.2346
IUPAC Name:
4-amino-6-[(6-fluoro-1H-indol-5-yl)oxy]pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C13H9FN4O2/c14-9-4-10-7(1-2-16-10)3-11(9)20-13-8(5-19)12(15)17-6-18-13/h1-6,16H,(H2,15,17,18)
InChI Key:
DEXMRDHGSLKJAE-UHFFFAOYSA-N
SMILES:
O=Cc1c(ncnc1N)Oc1cc2cc[nH]c2cc1F

Properties

Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.071g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
272.239g/mol
Monoisotopic Mass:
272.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
93.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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