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1105197-37-2 | 4-CYCLOPROPYL-1-(2-METHYLPHENYL)-1,6-DIHYDRO-7H-PYRAZOLO[3,4-D]PYRIDAZIN-+
CAS No: 1105197-37-2 Catalog No: AG01AROK MDL No:MFCD11986574
Product Description
Catalog Number:
AG01AROK
Chemical Name:
4-CYCLOPROPYL-1-(2-METHYLPHENYL)-1,6-DIHYDRO-7H-PYRAZOLO[3,4-D]PYRIDAZIN-+
CAS Number:
1105197-37-2
Molecular Formula:
C15H14N4O
Molecular Weight:
266.2979
MDL Number:
MFCD11986574
IUPAC Name:
4-cyclopropyl-1-(2-methylphenyl)-6H-pyrazolo[3,4-d]pyridazin-7-one
InChI:
InChI=1S/C15H14N4O/c1-9-4-2-3-5-12(9)19-14-11(8-16-19)13(10-6-7-10)17-18-15(14)20/h2-5,8,10H,6-7H2,1H3,(H,18,20)
InChI Key:
WKPNSPXTVPVEON-UHFFFAOYSA-N
SMILES:
Cc1ccccc1n1ncc2c1c(=O)[nH]nc2C1CC1
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.117g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.304g/mol
Monoisotopic Mass:
266.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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