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Lotixparib

CAT: 0013-GTR19264065-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19264065-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Lotixparib (Example 1) is an inhibitor of poly (ADP-ribose) polymerase-1 (PARP-1) . It exhibits cytoprotective properties in retinal diseases and can be utilized in research related to PARP-1 associated conditions.
CAS Number
2640677-63-8
Field of Research
Epigenetics & Chromatin, Molecular Biology
Smiles
N#CC1=CC=C (C=C1) N2CCN (CC2) CCCC3=CC=4C=CC=C (F) C4C (=O) N3
Molecular Formula
C23H23FN4O
Molecular Weight
390.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Lotixparib
CAS Number2640677-63-8
PubChem CID156317961
IUPAC Name4-[4-[3-(8-fluoro-1-oxo-2H-isoquinolin-3-yl)propyl]piperazin-1-yl]benzonitrile
Molecular FormulaC23H23FN4O
Molecular Weight390.5
XLogP3.4
Topological Polar Surface Area59.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity655
SMILES
C1CN(CCN1CCCC2=CC3=C(C(=CC=C3)F)C(=O)N2)C4=CC=C(C=C4)C#N
InChI
InChI=1S/C23H23FN4O/c24-21-5-1-3-18-15-19(26-23(29)22(18)21)4-2-10-27-11-13-28(14-12-27)20-8-6-17(16-25)7-9-20/h1,3,5-9,15H,2,4,10-14H2,(H,26,29)
InChIKey
LEXVZEFLIXAAMV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lotixparib
CAS: 2640677-63-8
CID: 156317961
Formula: C23H23FN4O
MW: 390.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight390.5
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass390.18558953
Monoisotopic Mass390.18558953
Topological Polar Surface Area59.4 Ų
Heavy Atom Count29
Formal Charge0
Complexity655
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
T211718-01Lotixparib

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