5-chloro-3-iodo-2H-pyrazolo[3,4-b]pyridine

5-chloro-3-iodo-2H-pyrazolo[3,4-b]pyridine

CAS: 1352395-64-2

Formula: C6H3ClIN3

SMILES: ClC1=CC2=C(I)NN=C2N=C1

IUPAC: 5-chloro-3-iodo-2H-pyrazolo[3,4-b]pyridine

InChI: InChI=1S/C6H3ClIN3/c7-3-1-4-5(8)10-11-6(4)9-2-3/h1-2H,(H,9,10,11)

Composition: C (25.79%), H (1.08%), Cl (12.68%), I (45.41%), N (15.04%)

Molar Mass: 279.47

Atom Count: 14

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	278.90602
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NPNSPKVLIQNOMB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.71
Topological Polar Surface Area	41.57
Polarizability	20.39
Ring Count	2
Rotatable Bond Count	0

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