Name: Name:Pyrido[4,3-d]pyrimidine-6(2H)-carboxylic acid,1,3,4,5,7,8-hexahydro-2,4-dioxo-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG00IEUU
Rating: 90 (10 reviews)

Pyrido[4,3-d]pyrimidine-6(2H)-carboxylic acid,1,3,4,5,7,8-hexahydro-2,4-dioxo-, 1,1-dimethylethyl ester

CAS No.:

880257-39-6

Catalog Number:

AG00IEUU

Molecular Formula:

C12H17N3O4

Molecular Weight:

267.2811

Catalog Number:

AG00IEUU

Chemical Name:

Pyrido[4,3-d]pyrimidine-6(2H)-carboxylic acid,1,3,4,5,7,8-hexahydro-2,4-dioxo-, 1,1-dimethylethyl ester

CAS Number:

880257-39-6

Molecular Formula:

C12H17N3O4

Molecular Weight:

267.2811

MDL Number:

MFCD26096482

IUPAC Name:

tert-butyl 2,4-dioxo-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-6-carboxylate

InChI:

InChI=1S/C12H17N3O4/c1-12(2,3)19-11(18)15-5-4-8-7(6-15)9(16)14-10(17)13-8/h4-6H2,1-3H3,(H2,13,14,16,17)

InChI Key:

JBLDCOQATXUSRZ-UHFFFAOYSA-N

SMILES:

Oc1nc(O)c2c(n1)CCN(C2)C(=O)OC(C)(C)C

Complexity:

476

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

267.122g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

267.285g/mol

Monoisotopic Mass:

267.122g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2