4-{2H-pyrazolo[3,4-b]pyridin-3-yl}piperidine trihydrochloride

4-{2H-pyrazolo[3,4-b]pyridin-3-yl}piperidine trihydrochloride

CAS: 1184982-95-3

Formula: C11H17Cl3N4

SMILES: Cl.Cl.Cl.C1CC(CCN1)C1=C2C=CC=NC2=NN1

IUPAC: 4-{2H-pyrazolo[3,4-b]pyridin-3-yl}piperidine trihydrochloride

InChI: InChI=1S/C11H14N4.3ClH/c1-2-9-10(8-3-6-12-7-4-8)14-15-11(9)13-5-1;;;/h1-2,5,8,12H,3-4,6-7H2,(H,13,14,15);3*1H

Composition: C (42.40%), H (5.50%), Cl (34.13%), N (17.98%)

Molar Mass: 311.64

Atom Count: 35

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	310.0518797
Formal Charge	0
FSP3	0.45
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	SIUZATYOFGYZFQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.61
Topological Polar Surface Area	53.6
Polarizability	23.02
Ring Count	3
Rotatable Bond Count	1

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