3-(piperazin-1-yl)-1,2-benzoxazole

3-(piperazin-1-yl)-1,2-benzoxazole

CAS: 87691-89-2

Formula: C11H13N3O

SMILES: C1CN(CCN1)C1=NOC2=CC=CC=C12

IUPAC: 3-(piperazin-1-yl)-1,2-benzoxazole

InChI: InChI=1S/C11H13N3O/c1-2-4-10-9(3-1)11(13-15-10)14-7-5-12-6-8-14/h1-4,12H,5-8H2

Composition: C (65.01%), H (6.45%), N (20.68%), O (7.87%)

Molar Mass: 203.245

Atom Count: 28

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	203.105862051
Formal Charge	0
FSP3	0.36
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZDFQBFVFCPABKQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.33
Topological Polar Surface Area	41.3
Polarizability	23.13
Ring Count	3
Rotatable Bond Count	1

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	87691-89-2		$51.35-$1,197.38$51.35$63.37$86.31$1,197.38

Kinentia Biosciences LLC

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<14 Days	87691-89-2		$94.50-$708.75$94.50$708.75