200,000+ products from a single source!
sales@angenechem.com
862119-63-9 | 1H-1,2,3-TRIAZOLE-4-METHANAMINE, 5,5'-[OXYBIS(1-PIPERIDINYLMETHYLENE)]BIS[N,N-DIMETHYL- (9CI)
CAS No: 862119-63-9 Catalog No: AG004NHA MDL No:
Product Description
Catalog Number:
AG004NHA
Chemical Name:
1H-1,2,3-TRIAZOLE-4-METHANAMINE, 5,5'-[OXYBIS(1-PIPERIDINYLMETHYLENE)]BIS[N,N-DIMETHYL- (9CI)
CAS Number:
862119-63-9
Molecular Formula:
C22H40N10O
Molecular Weight:
460.6194
IUPAC Name:
1-[5-[[[5-[(dimethylamino)methyl]-2H-triazol-4-yl]-piperidin-1-ylmethoxy]-piperidin-1-ylmethyl]-2H-triazol-4-yl]-N,N-dimethylmethanamine
InChI:
InChI=1S/C22H40N10O/c1-29(2)15-17-19(25-27-23-17)21(31-11-7-5-8-12-31)33-22(32-13-9-6-10-14-32)20-18(16-30(3)4)24-28-26-20/h21-22H,5-16H2,1-4H3,(H,23,25,27)(H,24,26,28)
InChI Key:
JFVXVBLPFMHRCK-UHFFFAOYSA-N
SMILES:
CN(Cc1nn[nH]c1C(N1CCCCC1)OC(c1[nH]nnc1CN(C)C)N1CCCCC1)C
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
460.339g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
460.631g/mol
Monoisotopic Mass:
460.339g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.