isoquinoline-4-carboxamide

isoquinoline-4-carboxamide

CAS: 7114-81-0

Formula: C10H8N2O

SMILES: NC(=O)C1=CN=CC2=CC=CC=C12

IUPAC: isoquinoline-4-carboxamide

InChI: InChI=1S/C10H8N2O/c11-10(13)9-6-12-5-7-3-1-2-4-8(7)9/h1-6H,(H2,11,13)

Composition: C (69.76%), H (4.68%), N (16.27%), O (9.29%)

Molar Mass: 172.187

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	172.063662886
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	JGNIYFRSFZEFCQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.43
Topological Polar Surface Area	55.98
Polarizability	19.79
Ring Count	2
Rotatable Bond Count	1

Suppliers

OTAVA LTD.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<10 Days	7114-81-0		$162.27$162.27

MFCD09999538

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	7114-81-0		$186.30-$644.81$186.30$323.96$644.81

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	7114-81-0		$1,760.00-$3,278.00$1,760.00$2,574.00$3,278.00

LabNetwork INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	1 Day	7114-81-0		$235.87-$2,476.66$235.87$412.78$825.55$2,476.66