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Home > Pyridines > 676491-46-6
676491-46-6 | 1H-Pyrrolo[2,3-c]pyridine, 4-Methoxy-7-(3-Methyl-1H-1,2,4-triazol-1-yl)-
CAS No: 676491-46-6 Catalog No: AG00FFEN MDL No:MFCD19105151
Product Description
Catalog Number:
AG00FFEN
Chemical Name:
1H-Pyrrolo[2,3-c]pyridine, 4-Methoxy-7-(3-Methyl-1H-1,2,4-triazol-1-yl)-
CAS Number:
676491-46-6
Molecular Formula:
C11H11N5O
Molecular Weight:
229.2379
MDL Number:
MFCD19105151
IUPAC Name:
4-methoxy-7-(3-methyl-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridine
InChI:
InChI=1S/C11H11N5O/c1-7-14-6-16(15-7)11-10-8(3-4-12-10)9(17-2)5-13-11/h3-6,12H,1-2H3
InChI Key:
UDEUJLHVKKTHFA-UHFFFAOYSA-N
SMILES:
COc1cnc(c2c1cc[nH]2)n1cnc(n1)C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.096g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.243g/mol
Monoisotopic Mass:
229.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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