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N4-Bz-adenine

CAT: 0931-TNU0626-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TNU0626-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
4005-49-6
Target
Others
Related Pathways
Others
Bioactivity
Heterocyclic compound-purine
Smiles
O=C(NC1=C2NC=NC2=NC=N1)C1=CC=CC=C1
Molecular Formula
C12H9N5O
Molecular Weight
239.23
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

6-Benzamidopurine

6-Benzamidopurine is a member of purines.

CAS Number4005-49-6
PubChem CID97075
IUPAC NameN-(7H-purin-6-yl)benzamide
Molecular FormulaC12H9N5O
Molecular Weight239.23
XLogP1.3
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity305
SMILES
C1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2NC=N3
InChI
InChI=1S/C12H9N5O/c18-12(8-4-2-1-3-5-8)17-11-9-10(14-6-13-9)15-7-16-11/h1-7H,(H2,13,14,15,16,17,18)
InChIKey
QQJXZVKXNSFHRI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-Benzamidopurine
CAS: 4005-49-6
CID: 97075
Formula: C12H9N5O
MW: 239.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight239.23
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass239.08070993
Monoisotopic Mass239.08070993
Topological Polar Surface Area83.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity305
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS5826222N4-Bz-adenine
HY-W675848N4-Bz-C- (S) -GNA phosphoramidite
MBS57981035'-O-DMT-N4-Bz-5-Me-dC
PC110540-015'-O-DMT-N4-Bz-2'-F-dC
M34917-015-O-DMT-N4-Bz-5-Me-dC
HY-W048494N4-Bz-5-Me-DMT-2'-O-MOE-Cr
MBS5827194N4-Bz-3'-O-DMTr-2'-deoxycytidine 5'-O-CE-phosphoramidite
HY-152300-01N4, N4-Dimethylcytidine
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