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56666-64-9 | 4-[(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-3-phenylisoxazol-5(4H)-one
CAS No: 56666-64-9 Catalog No: AG00EUF4 MDL No:
Product Description
Catalog Number:
AG00EUF4
Chemical Name:
4-[(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-3-phenylisoxazol-5(4H)-one
CAS Number:
56666-64-9
IUPAC Name:
4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]-3-phenyl-4H-1,2-oxazol-5-one
InChI:
InChI=1S/C19H15N5O3/c1-12-15(18(25)24(22-12)14-10-6-3-7-11-14)20-21-17-16(23-27-19(17)26)13-8-4-2-5-9-13/h2-11,15,17H,1H3
InChI Key:
DISKVXMKMUSDMG-UHFFFAOYSA-N
Properties
Complexity:
690
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.117g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.361g/mol
Monoisotopic Mass:
361.117g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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