Name: Name:3-bromo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazin-4-one
Brand: Angene
SKU: AG01BTN6
Rating: 90 (10 reviews)

3-bromo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazin-4-one

CAS No.:

1708944-49-3

Catalog Number:

AG01BTN6

Molecular Formula:

C6H6BrN3O

Molecular Weight:

216.0353

Catalog Number:

AG01BTN6

Chemical Name:

3-bromo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrazin-4-one

CAS Number:

1708944-49-3

Molecular Formula:

C6H6BrN3O

Molecular Weight:

216.0353

MDL Number:

MFCD30730617

IUPAC Name:

3-bromo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one

InChI:

InChI=1S/C6H6BrN3O/c7-4-3-9-10-2-1-8-6(11)5(4)10/h3H,1-2H2,(H,8,11)

InChI Key:

DJTINKMMVOABCE-UHFFFAOYSA-N

SMILES:

Brc1cnn2c1C(=O)NCC2

Complexity:

187

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.969g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

216.038g/mol

Monoisotopic Mass:

214.969g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2