5-(piperazin-1-yl)-1-benzofuran-2-carboxylic acid

5-(piperazin-1-yl)-1-benzofuran-2-carboxylic acid

CAS: 183288-47-3

Formula: C13H14N2O3

SMILES: OC(=O)C1=CC2=CC(=CC=C2O1)N1CCNCC1

IUPAC: 5-(piperazin-1-yl)-1-benzofuran-2-carboxylic acid

InChI: InChI=1S/C13H14N2O3/c16-13(17)12-8-9-7-10(1-2-11(9)18-12)15-5-3-14-4-6-15/h1-2,7-8,14H,3-6H2,(H,16,17)

Composition: C (63.40%), H (5.73%), N (11.38%), O (19.49%)

Molar Mass: 246.266

Atom Count: 32

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	246.100442319
Formal Charge	0
FSP3	0.31
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	XSDYUFFJOJVGMF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.22
Topological Polar Surface Area	65.71
Polarizability	26.34
Ring Count	3
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	183288-47-3		$48.65-$149.04$48.65$75.56$149.04

AA BLOCKS INC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<6 Days	183288-47-3		$115.00-$197.80$115.00$197.80

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	183288-47-3		$11,340.00-$6,048.00$6,048.00$11,340.00$14,176.00