200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 1105196-52-8
1105196-52-8 | 1-phenyl-4-(propan-2-yl)-1H,6H,7H-pyrazolo[3,4-d]pyridazin-7-one
CAS No: 1105196-52-8 Catalog No: AG01ARVW MDL No:MFCD11986547
Product Description
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
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.117g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.293g/mol
Monoisotopic Mass:
254.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.