200,000+ products from a single source!
sales@angenechem.com
121760-62-1 | 1,3,5-Triazine-2,4,6-triamine, N2,N4,N6-tris[(4-methylphenyl)methyl]-
CAS No: 121760-62-1 Catalog No: AG0015TW MDL No:
Product Description
Catalog Number:
AG0015TW
Chemical Name:
1,3,5-Triazine-2,4,6-triamine, N2,N4,N6-tris[(4-methylphenyl)methyl]-
CAS Number:
121760-62-1
Molecular Formula:
C27H30N6
Molecular Weight:
438.5673
IUPAC Name:
2-N,4-N,6-N-tris[(4-methylphenyl)methyl]-1,3,5-triazine-2,4,6-triamine
InChI:
InChI=1S/C27H30N6/c1-19-4-10-22(11-5-19)16-28-25-31-26(29-17-23-12-6-20(2)7-13-23)33-27(32-25)30-18-24-14-8-21(3)9-15-24/h4-15H,16-18H2,1-3H3,(H3,28,29,30,31,32,33)
InChI Key:
JHEQYAXYXVNNIE-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CNc1nc(NCc2ccc(cc2)C)nc(n1)NCc1ccc(cc1)C
Properties
Complexity:
447
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.253g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
438.579g/mol
Monoisotopic Mass:
438.253g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
Literature
| Title | Journal |
|---|---|
| The ESI CAD fragmentations of protonated 2,4,6-tris(benzylamino)- and tris(benzyloxy)-1,3,5-triazines involve benzyl-benzyl interactions: a DFT study. | Journal of mass spectrometry : JMS 20120701 |
| Synthesis and antibacterial activity of 2,4,6-tri substituted s-triazines. | Bioorganic & medicinal chemistry letters 20050215 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.