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Senaparib

CAT: 0931-T9593-03Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T9593-03Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1401682-78-7
Target
PARP
Related Pathways
DNA Damage/DNA Repair, Chromatin/Epigenetic
Purity
0.998
Bioactivity
Senaparib (IMP4297) is a novel highly potent and selective oral PARP1/2 inhibitor with strong antitumor activity.
Smiles
Fc1ccc(Cn2c3cccc(F)c3c(=O)[nH]c2=O)cc1C(=O)N1CCN(CC1)c1ncccn1
Molecular Formula
C24H20F2N6O3
Molecular Weight
478.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Senaparib

Senaparib is an orally bioavailable inhibitor of the nuclear enzymes poly (ADP-ribose) polymerase (PARP) 1 and 2, with potential antineoplastic activity. Upon administration, senaparib selectively binds to PARP 1 and 2 and prevents PARP-mediated DNA repair of single-strand DNA breaks via the base-excision repair pathway. This enhances the accumulation of DNA strand breaks and promotes genomic instability and eventually leads to apoptosis. PARP catalyzes post-translational ADP-ribosylation of nuclear proteins that signal and recruit other proteins to repair damaged DNA and is activated by single-strand DNA breaks.

CAS Number1401682-78-7
PubChem CID68389008
IUPAC Name5-fluoro-1-[[4-fluoro-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]methyl]quinazoline-2,4-dione
Molecular FormulaC24H20F2N6O3
Molecular Weight478.5
XLogP2
Topological Polar Surface Area98.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count35
Formal Charge0
Complexity804
SMILES
C1CN(CCN1C2=NC=CC=N2)C(=O)C3=C(C=CC(=C3)CN4C5=C(C(=CC=C5)F)C(=O)NC4=O)F
InChI
InChI=1S/C24H20F2N6O3/c25-17-6-5-15(14-32-19-4-1-3-18(26)20(19)21(33)29-24(32)35)13-16(17)22(34)30-9-11-31(12-10-30)23-27-7-2-8-28-23/h1-8,13H,9-12,14H2,(H,29,33,35)
InChIKey
VBTUJTGLLREMNW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Senaparib
CAS: 1401682-78-7
CID: 68389008
Formula: C24H20F2N6O3
MW: 478.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight478.5
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass478.15649485
Monoisotopic Mass478.15649485
Topological Polar Surface Area98.7 Ų
Heavy Atom Count35
Formal Charge0
Complexity804
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

Alternative Products

CatalogName
M28788-01Senaparib
HY-137450ASenaparib (hydrochloride)
MBS5813305Senaparib hydrochloride
462504Senaparib free base

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