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AC 3092

CAT: 0931-T29535-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T29535-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
7558-14-7
Target
Others
Related Pathways
Others
Bioactivity
AC 3092 is a bio-active chemical.
Smiles
O=C1C2=C(N=C(N2CCN3CCOCC3)CC=4C=CC=CC4)N(C(=O)N1C)C
Molecular Formula
C20H25N5O3
Molecular Weight
383.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

AC 3092
CAS Number7558-14-7
PubChem CID134646
IUPAC Name8-benzyl-1,3-dimethyl-7-(2-morpholin-4-ylethyl)purine-2,6-dione
Molecular FormulaC20H25N5O3
Molecular Weight383.4
XLogP1.1
Topological Polar Surface Area70.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity576
SMILES
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CC3=CC=CC=C3)CCN4CCOCC4
InChI
InChI=1S/C20H25N5O3/c1-22-18-17(19(26)23(2)20(22)27)25(9-8-24-10-12-28-13-11-24)16(21-18)14-15-6-4-3-5-7-15/h3-7H,8-14H2,1-2H3
InChIKey
XKKXBBFOYVNTDX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AC 3092
CAS: 7558-14-7
CID: 134646
Formula: C20H25N5O3
MW: 383.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight383.4
XLogP31.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass383.19573968
Monoisotopic Mass383.19573968
Topological Polar Surface Area70.9 Ų
Heavy Atom Count28
Formal Charge0
Complexity576
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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CatalogName
MBS5779169AC 3092
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HY-RI02973A-01Mmu-miR-3092-3p antagomir
HY-R02973-01Mmu-miR-3092-3p mimic
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