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AM6580

CAT: 0931-T71493-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T71493-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1072850-80-6
Target
Others
Related Pathways
Others
Bioactivity
AM6580 is an irreversible monoacylglycerol lipase (MGL) inhibitor.
Smiles
C(=O)(N1CCN(C2C=3C(C=4C2=CC=CC4)=CC=CC3)CC1)N5C=6C(N=N5)=NC=CC6
Molecular Formula
C23H20N6O
Molecular Weight
396.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

[4-(9H-fluoren-9-yl)piperazin-1-yl]-(triazolo[4,5-b]pyridin-1-yl)methanone
CAS Number1072850-80-6
PubChem CID25096356
IUPAC Name[4-(9H-fluoren-9-yl)piperazin-1-yl]-(triazolo[4,5-b]pyridin-1-yl)methanone
Molecular FormulaC23H20N6O
Molecular Weight396.4
XLogP3
Topological Polar Surface Area67.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count30
Formal Charge0
Complexity615
SMILES
C1CN(CCN1C2C3=CC=CC=C3C4=CC=CC=C24)C(=O)N5C6=C(N=CC=C6)N=N5
InChI
InChI=1S/C23H20N6O/c30-23(29-20-10-5-11-24-22(20)25-26-29)28-14-12-27(13-15-28)21-18-8-3-1-6-16(18)17-7-2-4-9-19(17)21/h1-11,21H,12-15H2
InChIKey
FZFRAGWORHDDSR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of [4-(9H-fluoren-9-yl)piperazin-1-yl]-(triazolo[4,5-b]pyridin-1-yl)methanone
CAS: 1072850-80-6
CID: 25096356
Formula: C23H20N6O
MW: 396.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight396.4
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass396.16985928
Monoisotopic Mass396.16985928
Topological Polar Surface Area67.2 Ų
Heavy Atom Count30
Formal Charge0
Complexity615
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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