200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 849071-65-4
849071-65-4 | 1H-Pyrazole, 5,5'-[1,1'-biphenyl]-4,4'-diylbis[4,5-dihydro-1,3-diphenyl-
CAS No: 849071-65-4 Catalog No: AG004LZU MDL No:
Product Description
Catalog Number:
AG004LZU
Chemical Name:
1H-Pyrazole, 5,5'-[1,1'-biphenyl]-4,4'-diylbis[4,5-dihydro-1,3-diphenyl-
CAS Number:
849071-65-4
Molecular Formula:
C42H34N4
Molecular Weight:
594.7462
IUPAC Name:
3-[4-[4-(2,5-diphenyl-3,4-dihydropyrazol-3-yl)phenyl]phenyl]-2,5-diphenyl-3,4-dihydropyrazole
InChI:
InChI=1S/C42H34N4/c1-5-13-33(14-6-1)39-29-41(45(43-39)37-17-9-3-10-18-37)35-25-21-31(22-26-35)32-23-27-36(28-24-32)42-30-40(34-15-7-2-8-16-34)44-46(42)38-19-11-4-12-20-38/h1-28,41-42H,29-30H2
InChI Key:
UQLPVYMSIVODLN-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)N1N=C(CC1c1ccc(cc1)c1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
928
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
594.278g/mol
Formal Charge:
0
Heavy Atom Count:
46
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
594.762g/mol
Monoisotopic Mass:
594.278g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
9.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.