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FIPI HCl

CAT: 0931-T3580L-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T3580L-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1781834-93-2
Target
Others, Phospholipase, Autophagy
Related Pathways
Metabolism, Others, Autophagy
Bioactivity
FIPI is an effective and selective phospholipase D inhibitor that reduces mercury-induced lipid signaling and thus protects aortic endothelial cells from cytotoxicity.
Smiles
Cl.O=C(NCCN1CCC(N2C(=O)NC=3C=CC=CC32)CC1)C4=CC=5C=C(F)C=CC5N4
Molecular Formula
C23H25ClFN5O2
Molecular Weight
457.93
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

FIPI hydrochloride
CAS Number1781834-93-2
PubChem CID90488864
IUPAC Name5-fluoro-N-[2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]ethyl]-1H-indole-2-carboxamide;hydrochloride
Molecular FormulaC23H25ClFN5O2
Molecular Weight457.9
Topological Polar Surface Area80.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count32
Formal Charge0
Complexity670
SMILES
C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCNC(=O)C4=CC5=C(N4)C=CC(=C5)F.Cl
InChI
InChI=1S/C23H24FN5O2.ClH/c24-16-5-6-18-15(13-16)14-20(26-18)22(30)25-9-12-28-10-7-17(8-11-28)29-21-4-2-1-3-19(21)27-23(29)31;/h1-6,13-14,17,26H,7-12H2,(H,25,30)(H,27,31);1H
InChIKey
BNMQCDOCYPGJJD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of FIPI hydrochloride
CAS: 1781834-93-2
CID: 90488864
Formula: C23H25ClFN5O2
MW: 457.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight457.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass457.1680809
Monoisotopic Mass457.1680809
Topological Polar Surface Area80.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity670
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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