Name: Name:5-Bromo-4-chloro-7-(phenylsulfonyl)-7h-pyrrolo[2,3-d]pyrimidine
Brand: Angene
SKU: AG00BG6R
Rating: 90 (10 reviews)

5-Bromo-4-chloro-7-(phenylsulfonyl)-7h-pyrrolo[2,3-d]pyrimidine

CAS No.:

252723-17-4

Catalog Number:

AG00BG6R

Molecular Formula:

C12H7BrClN3O2S

Molecular Weight:

372.6249

Catalog Number:

AG00BG6R

Chemical Name:

5-Bromo-4-chloro-7-(phenylsulfonyl)-7h-pyrrolo[2,3-d]pyrimidine

CAS Number:

252723-17-4

Molecular Formula:

C12H7BrClN3O2S

Molecular Weight:

372.6249

MDL Number:

MFCD11501900

IUPAC Name:

7-(benzenesulfonyl)-5-bromo-4-chloropyrrolo[2,3-d]pyrimidine

InChI:

InChI=1S/C12H7BrClN3O2S/c13-9-6-17(12-10(9)11(14)15-7-16-12)20(18,19)8-4-2-1-3-5-8/h1-7H

InChI Key:

IXXOMMSCNWTOPX-UHFFFAOYSA-N

SMILES:

Brc1cn(c2c1c(Cl)ncn2)S(=O)(=O)c1ccccc1

Complexity:

452

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

370.913g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

372.621g/mol

Monoisotopic Mass:

370.913g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5