6-bromo-8-methoxy-[1,2,4]triazolo[1,5-a]pyrazine

6-bromo-8-methoxy-[1,2,4]triazolo[1,5-a]pyrazine

CAS: 2169539-35-7

Formula: C6H5BrN4O

SMILES: COC1=NC(Br)=CN2N=CN=C12

IUPAC: 6-bromo-8-methoxy-[1,2,4]triazolo[1,5-a]pyrazine

InChI: InChI=1S/C6H5BrN4O/c1-12-6-5-8-3-9-11(5)2-4(7)10-6/h2-3H,1H3

Composition: C (31.46%), H (2.20%), Br (34.89%), N (24.46%), O (6.99%)

Molar Mass: 229.037

Atom Count: 17

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	227.964674
Formal Charge	0
FSP3	0.17
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	WFWZVVBGEDQSKX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.84
Topological Polar Surface Area	52.31
Polarizability	17.18
Ring Count	2
Rotatable Bond Count	1

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95%	<2 Days	2169539-35-7		$345.00-$1,604.25$345.00$488.75$1,006.25$1,604.25