Name: Name:tert-Butyl 2-(methylsulfonyl)-5h-pyrrolo[3,4-d]pyrimidine-6(7h)-carboxylate
Brand: Angene
SKU: AG00BYHH
Rating: 90 (10 reviews)

tert-Butyl 2-(methylsulfonyl)-5h-pyrrolo[3,4-d]pyrimidine-6(7h)-carboxylate

CAS No.:

365996-87-8

Catalog Number:

AG00BYHH

Molecular Formula:

C12H17N3O4S

Molecular Weight:

299.3461

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

100mg

95%

In Stock USA

United States

$197

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Catalog Number:

AG00BYHH

Chemical Name:

tert-Butyl 2-(methylsulfonyl)-5h-pyrrolo[3,4-d]pyrimidine-6(7h)-carboxylate

CAS Number:

365996-87-8

Molecular Formula:

C12H17N3O4S

Molecular Weight:

299.3461

MDL Number:

MFCD09839781

IUPAC Name:

tert-butyl 2-methylsulfonyl-5,7-dihydropyrrolo[3,4-d]pyrimidine-6-carboxylate

InChI:

InChI=1S/C12H17N3O4S/c1-12(2,3)19-11(16)15-6-8-5-13-10(20(4,17)18)14-9(8)7-15/h5H,6-7H2,1-4H3

InChI Key:

OWHKZXFLURWFDL-UHFFFAOYSA-N

SMILES:

O=C(N1Cc2c(C1)nc(nc2)S(=O)(=O)C)OC(C)(C)C

Complexity:

480

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.094g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

299.345g/mol

Monoisotopic Mass:

299.094g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

97.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.1