200,000+ products from a single source!
sales@angenechem.com
21141-58-2 | 1,2-Ethanediamine, N,N'-bis[2-[(6-chloro-2-methoxy-9-acridinyl)amino]ethyl]-, tetrahydrochloride (9CI)
CAS No: 21141-58-2 Catalog No: AG002LBJ MDL No:
Product Description
Catalog Number:
AG002LBJ
Chemical Name:
1,2-Ethanediamine, N,N'-bis[2-[(6-chloro-2-methoxy-9-acridinyl)amino]ethyl]-, tetrahydrochloride (9CI)
CAS Number:
21141-58-2
Molecular Formula:
C34H38Cl6N6O2
Molecular Weight:
775.4225
IUPAC Name:
N',N'-bis[2-[(6-chloro-2-methoxyacridin-9-yl)amino]ethyl]ethane-1,2-diamine
InChI:
InChI=1S/C34H34Cl2N6O2/c1-43-23-5-9-29-27(19-23)33(25-7-3-21(35)17-31(25)40-29)38-12-15-42(14-11-37)16-13-39-34-26-8-4-22(36)18-32(26)41-30-10-6-24(44-2)20-28(30)34/h3-10,17-20H,11-16,37H2,1-2H3,(H,38,40)(H,39,41)
InChI Key:
ZWOZBADCBYOCDV-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(NCCNCCNCCNc1c3cc(OC)ccc3nc3c1ccc(c3)Cl)c1c(n2)cc(cc1)Cl.Cl.Cl.Cl.Cl
Properties
Complexity:
825
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
628.212g/mol
Formal Charge:
0
Heavy Atom Count:
44
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
629.586g/mol
Monoisotopic Mass:
628.212g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.