200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 161806-39-9
161806-39-9 | 1H-Benzimidazole, 2-[2-(1H-indol-3-yl)ethyl]-
CAS No: 161806-39-9 Catalog No: AG001VWO MDL No:
Product Description
Catalog Number:
AG001VWO
Chemical Name:
1H-Benzimidazole, 2-[2-(1H-indol-3-yl)ethyl]-
CAS Number:
161806-39-9
Molecular Formula:
C17H15N3
Molecular Weight:
261.3211
IUPAC Name:
2-[2-(1H-indol-3-yl)ethyl]-1H-benzimidazole
InChI:
InChI=1S/C17H15N3/c1-2-6-14-13(5-1)12(11-18-14)9-10-17-19-15-7-3-4-8-16(15)20-17/h1-8,11,18H,9-10H2,(H,19,20)
InChI Key:
RZJAUSDHHRSXHT-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c(CCc1nc3c([nH]1)cccc3)c[nH]2
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.127g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.328g/mol
Monoisotopic Mass:
261.127g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.