200,000+ products from a single source!
sales@angenechem.com
1198-47-6 | 9H-Purin-2-amine, 6-(methylthio)-
CAS No: 1198-47-6 Catalog No: AG000PNT MDL No:MFCD00044701
Product Description
Catalog Number:
AG000PNT
Chemical Name:
9H-Purin-2-amine, 6-(methylthio)-
CAS Number:
1198-47-6
Molecular Formula:
C6H7N5S
Molecular Weight:
181.2183
MDL Number:
MFCD00044701
IUPAC Name:
6-methylsulfanyl-7H-purin-2-amine
InChI:
InChI=1S/C6H7N5S/c1-12-5-3-4(9-2-8-3)10-6(7)11-5/h2H,1H3,(H3,7,8,9,10,11)
InChI Key:
YEGKYFQLKYGHAR-UHFFFAOYSA-N
SMILES:
CSc1nc(N)nc2c1nc[nH]2
EC Number:
214-833-4
UNII:
QNV75HJN3A
NSC Number:
29420
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.042g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.217g/mol
Monoisotopic Mass:
181.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| 6-Thioguanine and S⁶-methylthioguanine are mutagenic in human cells. | ACS chemical biology 20101119 |
| LC-MS/MS coupled with stable isotope dilution method for the quantification of 6-thioguanine and S(6)-methylthioguanine in genomic DNA of human cancer cells treated with 6-thioguanine. | Analytical chemistry 20100701 |
| Crystallographic and docking studies of purine nucleoside phosphorylase from Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry 20100701 |
| The syntheses and properties of tricyclic pyrrolo[2,3-d]pyrimidine analogues of S6-methylthioguanine and O6-methylguanine. | Organic & biomolecular chemistry 20060507 |
| Reference intervals for thiopurine S-methyltransferase activity in red blood cells using 6-thioguanine as substrate and rapid non-extraction liquid chromatography. | Annals of clinical biochemistry 20040701 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.