4,6-Dichloronicotinamide - CAS 70593-57-6

Catalog:	BB034189
Product Name:	4,6-Dichloronicotinamide
CAS:	70593-57-6
Synonyms:	4,6-dichloro-3-pyridinecarboxamide; 4,6-dichloropyridine-3-carboxamide

Technical Data

Patents

Computed Properties

IUPAC Name:	4,6-dichloropyridine-3-carboxamide
Description:	4,6-Dichloronicotinamide (CAS# 70593-57-6) is a useful research chemical.
Molecular Weight:	191.01
Molecular Formula:	C6H4Cl2N2O
Canonical SMILES:	C1=C(C(=CN=C1Cl)C(=O)N)Cl
InChI:	InChI=1S/C6H4Cl2N2O/c7-4-1-5(8)10-2-3(4)6(9)11/h1-2H,(H2,9,11)
InChI Key:	IQVYHPUXNYVYFW-UHFFFAOYSA-N
Boiling Point:	302.9 °C at 760 mmHg
Density:	1.524 g/cm³
MDL:	MFCD01646073
LogP:	2.18760

Publication Number	Title	Priority Date
CN-112552294-A	Piperazine heterocyclic derivative inhibitor, preparation method and application thereof	20190910
WO-2020092196-A1	Amide-substituted heterocyclic compounds for the treatment of conditions related to the modulation of il-12, il-23 and/or ifn-alpha	20181030
CN-113227071-A	Amide-substituted heterocyclic compounds for the treatment of disorders associated with the modulation of IL-12, IL-23 and/or IFN-alpha	20181030
EP-3873892-A1	Amide-substituted heterocyclic compounds for the treatment of conditions related to the modulation of il-12, il-23 and/or ifn-alpha	20181030
KR-20210086674-A	Amide-substituted heterocyclic compounds for the treatment of conditions associated with modulation of IL-12, IL-23 and/or IFN-alpha	20181030

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Complexity:	165
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.9700681
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	189.9700681
Rotatable Bond Count:	1
Topological Polar Surface Area:	56
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3