200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 142231-68-3
142231-68-3 | 1H-Pyrazol-4-ol, 5-[2-(4-methylphenyl)diazenyl]-1-phenyl-3-(phenylsulfonyl)-
CAS No: 142231-68-3 Catalog No: AG001I10 MDL No:
Product Description
Catalog Number:
AG001I10
Chemical Name:
1H-Pyrazol-4-ol, 5-[2-(4-methylphenyl)diazenyl]-1-phenyl-3-(phenylsulfonyl)-
CAS Number:
142231-68-3
Molecular Formula:
C22H18N4O3S
Molecular Weight:
418.4683
IUPAC Name:
3-(benzenesulfonyl)-5-[(4-methylphenyl)diazenyl]-1-phenylpyrazol-4-ol
InChI:
InChI=1S/C22H18N4O3S/c1-16-12-14-17(15-13-16)23-24-21-20(27)22(25-26(21)18-8-4-2-5-9-18)30(28,29)19-10-6-3-7-11-19/h2-15,27H,1H3
InChI Key:
QITGHNVSQNSUGU-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)N=Nc1n(nc(c1O)S(=O)(=O)c1ccccc1)c1ccccc1
Properties
Complexity:
675
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
418.11g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
418.471g/mol
Monoisotopic Mass:
418.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.