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NU1085

CAT: 0013-GTR19208640-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19208640-03Size:100 mg
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Description
NU1085 is a potent PARP inhibitor (Ki = 6 nM) that enhances the cytotoxic effects of ionizing radiation and chemotherapeutic agents like temozolomide and topotecan. Its activity has been demonstrated in vitro across multiple human cancer cell lines, supporting research in DNA damage response and combination therapy for oncology.
CAS Number
188106-83-4
Smiles
NC (=O) c1cccc2nc ([nH]c12) -c1ccc (O) cc1
Molecular Formula
C14H11N3O2
Molecular Weight
253.26
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-(4-hydroxyphenyl)-1H-benzimidazole-4-carboxamide

structure in first source

CAS Number188106-83-4
PubChem CID135546482
IUPAC Name2-(4-hydroxyphenyl)-1H-benzimidazole-4-carboxamide
Molecular FormulaC14H11N3O2
Molecular Weight253.26
XLogP1.7
Topological Polar Surface Area92
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity342
SMILES
C1=CC(=C2C(=C1)NC(=N2)C3=CC=C(C=C3)O)C(=O)N
InChI
InChI=1S/C14H11N3O2/c15-13(19)10-2-1-3-11-12(10)17-14(16-11)8-4-6-9(18)7-5-8/h1-7,18H,(H2,15,19)(H,16,17)
InChIKey
KOUGHMOSYJCJLE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(4-hydroxyphenyl)-1H-benzimidazole-4-carboxamide
CAS: 188106-83-4
CID: 135546482
Formula: C14H11N3O2
MW: 253.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight253.26
XLogP31.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass253.085126602
Monoisotopic Mass253.085126602
Topological Polar Surface Area92 Ų
Heavy Atom Count19
Formal Charge0
Complexity342
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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