200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 649728-50-7
649728-50-7 | Benzothiazole, 2,2'-[1,4-phenylenebis(1-methyl-1H-indole-2,3-diyl)]bis-
CAS No: 649728-50-7 Catalog No: AG00H783 MDL No:
Product Description
Catalog Number:
AG00H783
Chemical Name:
Benzothiazole, 2,2'-[1,4-phenylenebis(1-methyl-1H-indole-2,3-diyl)]bis-
CAS Number:
649728-50-7
Molecular Formula:
C38H26N4S2
Molecular Weight:
602.7698
IUPAC Name:
2-[2-[4-[3-(1,3-benzothiazol-2-yl)-1-methylindol-2-yl]phenyl]-1-methylindol-3-yl]-1,3-benzothiazole
InChI:
InChI=1S/C38H26N4S2/c1-41-29-15-7-3-11-25(29)33(37-39-27-13-5-9-17-31(27)43-37)35(41)23-19-21-24(22-20-23)36-34(26-12-4-8-16-30(26)42(36)2)38-40-28-14-6-10-18-32(28)44-38/h3-22H,1-2H3
InChI Key:
HUFFHQKKGSWZSH-UHFFFAOYSA-N
SMILES:
Cn1c2ccccc2c(c1c1ccc(cc1)c1c(c2nc3c(s2)cccc3)c2c(n1C)cccc2)c1nc2c(s1)cccc2
Properties
Complexity:
925
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
602.16g/mol
Formal Charge:
0
Heavy Atom Count:
44
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
602.774g/mol
Monoisotopic Mass:
602.16g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
92.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.