Name: Name:1H-Pyrrolo[2,3-b]pyridine, 4-chloro-5-iodo-1-(phenylsulfonyl)-
Brand: Angene
SKU: AG008TB8
Rating: 90 (10 reviews)

1H-Pyrrolo[2,3-b]pyridine, 4-chloro-5-iodo-1-(phenylsulfonyl)-

CAS No.:

1196507-56-8

Catalog Number:

AG008TB8

Molecular Formula:

C13H8ClIN2O2S

Molecular Weight:

418.6373

Catalog Number:

AG008TB8

Chemical Name:

1H-Pyrrolo[2,3-b]pyridine, 4-chloro-5-iodo-1-(phenylsulfonyl)-

CAS Number:

1196507-56-8

Molecular Formula:

C13H8ClIN2O2S

Molecular Weight:

418.6373

MDL Number:

MFCD15529390

IUPAC Name:

1-(benzenesulfonyl)-4-chloro-5-iodopyrrolo[2,3-b]pyridine

InChI:

InChI=1S/C13H8ClIN2O2S/c14-12-10-6-7-17(13(10)16-8-11(12)15)20(18,19)9-4-2-1-3-5-9/h1-8H

InChI Key:

VXWPLQTVHINTNQ-UHFFFAOYSA-N

SMILES:

Ic1cnc2c(c1Cl)ccn2S(=O)(=O)c1ccccc1

Complexity:

450

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

417.904g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

418.633g/mol

Monoisotopic Mass:

417.904g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8