200,000+ products from a single source!
sales@angenechem.com
1227267-13-1 | 1H-Pyrrolo[2,3-b]pyridine, 2-iodo-5-methoxy-1-(phenylsulfonyl)-
CAS No: 1227267-13-1 Catalog No: AG000J36 MDL No:MFCD16875774
Product Description
Catalog Number:
AG000J36
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 2-iodo-5-methoxy-1-(phenylsulfonyl)-
CAS Number:
1227267-13-1
Molecular Formula:
C14H11IN2O3S
Molecular Weight:
414.2182
MDL Number:
MFCD16875774
IUPAC Name:
1-(benzenesulfonyl)-2-iodo-5-methoxypyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C14H11IN2O3S/c1-20-11-7-10-8-13(15)17(14(10)16-9-11)21(18,19)12-5-3-2-4-6-12/h2-9H,1H3
InChI Key:
XFHBNYATZASEND-UHFFFAOYSA-N
SMILES:
COc1cnc2c(c1)cc(n2S(=O)(=O)c1ccccc1)I
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
413.954g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
414.217g/mol
Monoisotopic Mass:
413.954g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.