Name: Name:5,7-dimethyl-1H,2H,4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-2-one
Brand: Angene
SKU: AG01A9WF
Rating: 90 (10 reviews)

5,7-dimethyl-1H,2H,4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-2-one

CAS No.:

1258640-91-3

Catalog Number:

AG01A9WF

Molecular Formula:

C8H13N3O

Molecular Weight:

167.2083

Catalog Number:

AG01A9WF

Chemical Name:

5,7-dimethyl-1H,2H,4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-2-one

CAS Number:

1258640-91-3

Molecular Formula:

C8H13N3O

Molecular Weight:

167.2083

MDL Number:

MFCD17167125

IUPAC Name:

5,7-dimethyl-4,5,6,7-tetrahydro-1H-pyrazolo[1,5-a]pyrimidin-2-one

InChI:

InChI=1S/C8H13N3O/c1-5-3-6(2)11-7(9-5)4-8(12)10-11/h4-6,9H,3H2,1-2H3,(H,10,12)

InChI Key:

NAKGVVXLLRPXJL-UHFFFAOYSA-N

SMILES:

CC1CC(C)Nc2n1[nH]c(=O)c2

Complexity:

249

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

167.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

167.212g/mol

Monoisotopic Mass:

167.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1