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Home Other Building Blocks N-[5-(4-Cyanophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-3-pyridinecarboxamide

N-[5-(4-Cyanophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-3-pyridinecarboxamide

CAS No.:
1093222-27-5
Catalog Number:
AG008THD
Molecular Formula:
C20H13N5O
Molecular Weight:
339.3501
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$439
- +
10mg
98%
1 week
United States
$548
- +
50mg
98%
1 week
United States
$1385
- +
Product Description
Catalog Number:
AG008THD
Chemical Name:
N-[5-(4-Cyanophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-3-pyridinecarboxamide
CAS Number:
1093222-27-5
Molecular Formula:
C20H13N5O
Molecular Weight:
339.3501
MDL Number:
MFCD15528944
IUPAC Name:
N-[5-(4-cyanophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide
InChI:
InChI=1S/C20H13N5O/c21-9-13-3-5-14(6-4-13)16-8-17-18(12-24-19(17)23-11-16)25-20(26)15-2-1-7-22-10-15/h1-8,10-12H,(H,23,24)(H,25,26)
InChI Key:
JTSLALYXYSRPGW-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1cnc2c(c1)c(c[nH]2)NC(=O)c1cccnc1
Properties
Complexity:
550  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.112g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
339.358g/mol
Monoisotopic Mass:
339.112g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
94.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Assessment of chemical coverage of kinome space and its implications for kinase drug discovery. Journal of medicinal chemistry 20081225
Properties