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192587-25-0 | 4-Pteridinamine, 6-methyl-2-(methylthio)-
CAS No: 192587-25-0 Catalog No: AG002G3Y MDL No:
Product Description
Catalog Number:
AG002G3Y
Chemical Name:
4-Pteridinamine, 6-methyl-2-(methylthio)-
CAS Number:
192587-25-0
Molecular Formula:
C8H9N5S
Molecular Weight:
207.2556
IUPAC Name:
6-methyl-2-methylsulfanylpteridin-4-amine
InChI:
InChI=1S/C8H9N5S/c1-4-3-10-7-5(11-4)6(9)12-8(13-7)14-2/h3H,1-2H3,(H2,9,10,12,13)
InChI Key:
XRRAJRHGEBRQPK-UHFFFAOYSA-N
SMILES:
CSc1nc(N)c2c(n1)ncc(n2)C
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.255g/mol
Monoisotopic Mass:
207.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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