2-bromo-7-chloro-5H-pyrrolo[2,3-b]pyrazine

2-bromo-7-chloro-5H-pyrrolo[2,3-b]pyrazine

CAS: 1150617-58-5

Formula: C6H3BrClN3

SMILES: ClC1=CNC2=NC=C(Br)N=C12

IUPAC: 2-bromo-7-chloro-5H-pyrrolo[2,3-b]pyrazine

InChI: InChI=1S/C6H3BrClN3/c7-4-2-10-6-5(11-4)3(8)1-9-6/h1-2H,(H,9,10)

Composition: C (31.00%), H (1.30%), Br (34.37%), Cl (15.25%), N (18.08%)

Molar Mass: 232.47

Atom Count: 14

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	230.919888
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	VKBKVPMFSIOUCS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.68
Topological Polar Surface Area	41.57
Polarizability	18.02
Ring Count	2
Rotatable Bond Count	0

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