Name: Name:8-Chloro-2-(methylthio)pyrimido[5,4-d]pyrimidine
Brand: Angene
SKU: AG0024S5
Rating: 90 (10 reviews)

8-Chloro-2-(methylthio)pyrimido[5,4-d]pyrimidine

CAS No.:

176637-10-8

Catalog Number:

AG0024S5

Molecular Formula:

C7H5ClN4S

Molecular Weight:

212.6594

Catalog Number:

AG0024S5

Chemical Name:

8-Chloro-2-(methylthio)pyrimido[5,4-d]pyrimidine

CAS Number:

176637-10-8

Molecular Formula:

C7H5ClN4S

Molecular Weight:

212.6594

MDL Number:

MFCD00227587

IUPAC Name:

4-chloro-6-methylsulfanylpyrimido[5,4-d]pyrimidine

InChI:

InChI=1S/C7H5ClN4S/c1-13-7-9-2-4-5(12-7)6(8)11-3-10-4/h2-3H,1H3

InChI Key:

YBAUXEUJXJTKCH-UHFFFAOYSA-N

SMILES:

CSc1ncc2c(n1)c(Cl)ncn2

Complexity:

182

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

211.992g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

212.655g/mol

Monoisotopic Mass:

211.992g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7