Name: Name:5-Chloro-3-iodo-1-(4-methylbenzenesulfonyl)-1h-pyrrolo[2,3-b]pyridine
Brand: Angene
SKU: AG000LL9
Rating: 90 (10 reviews)

5-Chloro-3-iodo-1-(4-methylbenzenesulfonyl)-1h-pyrrolo[2,3-b]pyridine

CAS No.:

1241675-24-0

Catalog Number:

AG000LL9

Molecular Formula:

C14H10ClIN2O2S

Molecular Weight:

432.6639

Catalog Number:

AG000LL9

Chemical Name:

5-Chloro-3-iodo-1-(4-methylbenzenesulfonyl)-1h-pyrrolo[2,3-b]pyridine

CAS Number:

1241675-24-0

Molecular Formula:

C14H10ClIN2O2S

Molecular Weight:

432.6639

IUPAC Name:

5-chloro-3-iodo-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine

InChI:

InChI=1S/C14H10ClIN2O2S/c1-9-2-4-11(5-3-9)21(19,20)18-8-13(16)12-6-10(15)7-17-14(12)18/h2-8H,1H3

InChI Key:

NJVXZTXQZUABTK-UHFFFAOYSA-N

SMILES:

Cc1ccc(cc1)S(=O)(=O)n1cc(c2c1ncc(c2)Cl)I

Complexity:

476

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

431.92g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

432.66g/mol

Monoisotopic Mass:

431.92g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

60.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1