200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 89307-09-5
89307-09-5 | Carbamic acid, [5-(octylsulfonyl)-1H-benzimidazol-2-yl]-, methyl ester
CAS No: 89307-09-5 Catalog No: AG003ZY4 MDL No:
Product Description
Catalog Number:
AG003ZY4
Chemical Name:
Carbamic acid, [5-(octylsulfonyl)-1H-benzimidazol-2-yl]-, methyl ester
CAS Number:
89307-09-5
Molecular Formula:
C17H25N3O4S
Molecular Weight:
367.4631
IUPAC Name:
methyl N-(6-octylsulfonyl-1H-benzimidazol-2-yl)carbamate
InChI:
InChI=1S/C17H25N3O4S/c1-3-4-5-6-7-8-11-25(22,23)13-9-10-14-15(12-13)19-16(18-14)20-17(21)24-2/h9-10,12H,3-8,11H2,1-2H3,(H2,18,19,20,21)
InChI Key:
CSOLXXUDCWOBSG-UHFFFAOYSA-N
SMILES:
CCCCCCCCS(=O)(=O)c1ccc2c(c1)nc([nH]2)NC(=O)OC
Properties
Complexity:
521
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.157g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
367.464g/mol
Monoisotopic Mass:
367.157g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.