Name: Name:N-(4-Chloro-5-iodo-7h-pyrrolo[2,3-d]pyrimidin-2-yl)-2,2-dimethylpropionamide
Brand: Angene
SKU: AG001LZK
Rating: 90 (10 reviews)

N-(4-Chloro-5-iodo-7h-pyrrolo[2,3-d]pyrimidin-2-yl)-2,2-dimethylpropionamide

CAS No.:

149765-16-2

Catalog Number:

AG001LZK

Molecular Formula:

C11H12ClIN4O

Molecular Weight:

378.5966

Catalog Number:

AG001LZK

Chemical Name:

N-(4-Chloro-5-iodo-7h-pyrrolo[2,3-d]pyrimidin-2-yl)-2,2-dimethylpropionamide

CAS Number:

149765-16-2

Molecular Formula:

C11H12ClIN4O

Molecular Weight:

378.5966

MDL Number:

MFCD11109808

IUPAC Name:

N-(4-chloro-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-2-yl)-2,2-dimethylpropanamide

InChI:

InChI=1S/C11H12ClIN4O/c1-11(2,3)9(18)17-10-15-7(12)6-5(13)4-14-8(6)16-10/h4H,1-3H3,(H2,14,15,16,17,18)

InChI Key:

KZDHRXDFCHHFEJ-UHFFFAOYSA-N

SMILES:

O=C(C(C)(C)C)Nc1nc(Cl)c2c(n1)[nH]cc2I

Complexity:

336

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

377.974g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

378.598g/mol

Monoisotopic Mass:

377.974g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2