Name: Name:1H-Pyrazolo[3,4-d]pyrimidine, 6-chloro-3-iodo-
Brand: Angene
SKU: AG001ATF
Rating: 90 (10 reviews)

1H-Pyrazolo[3,4-d]pyrimidine, 6-chloro-3-iodo-

CAS No.:

1393547-40-4

Catalog Number:

AG001ATF

Molecular Formula:

C5H2ClIN4

Molecular Weight:

280.4536

Catalog Number:

AG001ATF

Chemical Name:

1H-Pyrazolo[3,4-d]pyrimidine, 6-chloro-3-iodo-

CAS Number:

1393547-40-4

Molecular Formula:

C5H2ClIN4

Molecular Weight:

280.4536

MDL Number:

MFCD21604208

IUPAC Name:

6-chloro-3-iodo-2H-pyrazolo[3,4-d]pyrimidine

InChI:

InChI=1S/C5H2ClIN4/c6-5-8-1-2-3(7)10-11-4(2)9-5/h1H,(H,8,9,10,11)

InChI Key:

YUSZIWUWJGUQFX-UHFFFAOYSA-N

SMILES:

Clc1ncc2c(n1)[nH]nc2I

Complexity:

157

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.901g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.453g/mol

Monoisotopic Mass:

279.901g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8