Name: Name:1-phenyl-4-(propan-2-yl)-1H,6H,7H-pyrazolo[3,4-d]pyridazin-7-one
Brand: Angene
SKU: AG01ARVW
Rating: 90 (10 reviews)

1-phenyl-4-(propan-2-yl)-1H,6H,7H-pyrazolo[3,4-d]pyridazin-7-one

CAS No.:

1105196-52-8

Catalog Number:

AG01ARVW

Molecular Formula:

C14H14N4O

Molecular Weight:

254.2872

Catalog Number:

AG01ARVW

Chemical Name:

1-phenyl-4-(propan-2-yl)-1H,6H,7H-pyrazolo[3,4-d]pyridazin-7-one

CAS Number:

1105196-52-8

Molecular Formula:

C14H14N4O

Molecular Weight:

254.2872

MDL Number:

MFCD11986547

IUPAC Name:

1-phenyl-4-propan-2-yl-6H-pyrazolo[3,4-d]pyridazin-7-one

InChI:

InChI=1S/C14H14N4O/c1-9(2)12-11-8-15-18(10-6-4-3-5-7-10)13(11)14(19)17-16-12/h3-9H,1-2H3,(H,17,19)

InChI Key:

XELFGRJAZKMVIN-UHFFFAOYSA-N

SMILES:

CC(c1n[nH]c(=O)c2c1cnn2c1ccccc1)C

Complexity:

387

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.117g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.293g/mol

Monoisotopic Mass:

254.117g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4