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303985-34-4

303985-34-4 | (3E)-3-(2-phenylhydrazin-1-ylidene)-1-{[3-(trifluoromethyl)phenyl]methyl}-2,3-dihydro-1H-indol-2-one

CAS No: 303985-34-4 Catalog No: AG00IV0Q MDL No:MFCD00975842

Product Description

Catalog Number:
AG00IV0Q
Chemical Name:
(3E)-3-(2-phenylhydrazin-1-ylidene)-1-{[3-(trifluoromethyl)phenyl]methyl}-2,3-dihydro-1H-indol-2-one
CAS Number:
303985-34-4
Molecular Formula:
C22H16F3N3O
Molecular Weight:
395.3771
MDL Number:
MFCD00975842
IUPAC Name:
3-phenyldiazenyl-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-ol
InChI:
InChI=1S/C22H16F3N3O/c23-22(24,25)16-8-6-7-15(13-16)14-28-19-12-5-4-11-18(19)20(21(28)29)27-26-17-9-2-1-3-10-17/h1-13,29H,14H2
InChI Key:
KNSIVQRZKNHCMH-UHFFFAOYSA-N
SMILES:
O=C1N(Cc2cccc(c2)C(F)(F)F)c2c(/C/1=N\Nc1ccccc1)cccc2

Properties

Complexity:
564  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.125g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
395.385g/mol
Monoisotopic Mass:
395.125g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2  

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