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6971-26-2 | 2,6-dichloro-9-phenyl-9h-purine
CAS No: 6971-26-2 Catalog No: AG005ISH MDL No:
Product Description
Catalog Number:
AG005ISH
Chemical Name:
2,6-dichloro-9-phenyl-9h-purine
CAS Number:
6971-26-2
Molecular Formula:
C11H6Cl2N4
Molecular Weight:
265.0981
IUPAC Name:
2,6-dichloro-9-phenylpurine
InChI:
InChI=1S/C11H6Cl2N4/c12-9-8-10(16-11(13)15-9)17(6-14-8)7-4-2-1-3-5-7/h1-6H
InChI Key:
PUARFAPITOZVIH-UHFFFAOYSA-N
SMILES:
Clc1nc(Cl)c2c(n1)n(cn2)c1ccccc1
NSC Number:
19098
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.997g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.097g/mol
Monoisotopic Mass:
263.997g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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