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162320-37-8 | 9H-Purin-2-amine, 6-(2-thienylmethoxy)-
CAS No: 162320-37-8 Catalog No: AG001T0H MDL No:
Product Description
Catalog Number:
AG001T0H
Chemical Name:
9H-Purin-2-amine, 6-(2-thienylmethoxy)-
CAS Number:
162320-37-8
Molecular Formula:
C10H9N5OS
Molecular Weight:
247.2764
IUPAC Name:
6-(thiophen-2-ylmethoxy)-7H-purin-2-amine
InChI:
InChI=1S/C10H9N5OS/c11-10-14-8-7(12-5-13-8)9(15-10)16-4-6-2-1-3-17-6/h1-3,5H,4H2,(H3,11,12,13,14,15)
InChI Key:
WDUFMAVWDXZOMA-UHFFFAOYSA-N
SMILES:
Nc1nc(OCc2cccs2)c2c(n1)[nH]cn2
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.053g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.276g/mol
Monoisotopic Mass:
247.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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