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1009838-57-6

1009838-57-6 | 1H-Pyrrolo[2,3-b]pyridine-3-carbonitrile, 4-(2,4-dichlorophenyl)-

CAS No: 1009838-57-6 Catalog No: AG0003DB MDL No:

Product Description

Catalog Number:
AG0003DB
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-3-carbonitrile, 4-(2,4-dichlorophenyl)-
CAS Number:
1009838-57-6
Molecular Formula:
C14H7Cl2N3
Molecular Weight:
288.1315
IUPAC Name:
4-(2,4-dichlorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
InChI:
InChI=1S/C14H7Cl2N3/c15-9-1-2-10(12(16)5-9)11-3-4-18-14-13(11)8(6-17)7-19-14/h1-5,7H,(H,18,19)
InChI Key:
LNCBSHUAZMAGOJ-UHFFFAOYSA-N
SMILES:
N#Cc1c[nH]c2c1c(ccn2)c1ccc(cc1Cl)Cl

Properties

Complexity:
380  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.002g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
288.131g/mol
Monoisotopic Mass:
287.002g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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