200,000+ products from a single source!
sales@angenechem.com
86764-78-5 | Thiourea, N,N-bis(phenylmethyl)-N'-[3-(trifluoromethyl)phenyl]-
CAS No: 86764-78-5 Catalog No: AG004SBB MDL No:
Product Description
Catalog Number:
AG004SBB
Chemical Name:
Thiourea, N,N-bis(phenylmethyl)-N'-[3-(trifluoromethyl)phenyl]-
CAS Number:
86764-78-5
Molecular Formula:
C22H19F3N2S
Molecular Weight:
400.4599
IUPAC Name:
1,1-dibenzyl-3-[3-(trifluoromethyl)phenyl]thiourea
InChI:
InChI=1S/C22H19F3N2S/c23-22(24,25)19-12-7-13-20(14-19)26-21(28)27(15-17-8-3-1-4-9-17)16-18-10-5-2-6-11-18/h1-14H,15-16H2,(H,26,28)
InChI Key:
UAUNTPMSJKECIG-UHFFFAOYSA-N
SMILES:
S=C(N(Cc1ccccc1)Cc1ccccc1)Nc1cccc(c1)C(F)(F)F
Properties
Complexity:
465
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
400.122g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
400.463g/mol
Monoisotopic Mass:
400.122g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.