Name: Name:ethyl 4-(methylamino)-2-(methylsulfonyl)pyrimidine-5-carboxylate
Brand: Angene
SKU: AG01DD37
Rating: 90 (10 reviews)

ethyl 4-(methylamino)-2-(methylsulfonyl)pyrimidine-5-carboxylate

CAS No.:

888493-43-4

Catalog Number:

AG01DD37

Molecular Formula:

C9H13N3O4S

Molecular Weight:

259.2822

Catalog Number:

AG01DD37

Chemical Name:

ethyl 4-(methylamino)-2-(methylsulfonyl)pyrimidine-5-carboxylate

CAS Number:

888493-43-4

Molecular Formula:

C9H13N3O4S

Molecular Weight:

259.2822

MDL Number:

MFCD31652192

IUPAC Name:

ethyl 4-(methylamino)-2-methylsulfinylpyrimidine-5-carboxylate

InChI:

InChI=1S/C9H13N3O3S/c1-4-15-8(13)6-5-11-9(16(3)14)12-7(6)10-2/h5H,4H2,1-3H3,(H,10,11,12)

InChI Key:

OSHLJFLVWZVXHH-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cnc(nc1NC)S(=O)(=O)C

Complexity:

275

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.068g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.281g/mol

Monoisotopic Mass:

243.068g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

100A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7