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PCNA-I1

CAT: 0013-GTR19166983-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19166983-07Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
PCNA-I1 is a small molecule inhibitor that disrupts the association of proliferating cell nuclear antigen (PCNA) with chromatin. It is a research tool used in vitro and in vivo to study DNA replication and repair mechanisms in prostate cancer and other oncology fields.
CAS Number
444930-42-1
Product Name Alternative
DNA/RNA Synthesis, PCNA I1, PCNAI1, PCNA-I1, PCNA-I-1, PCNA, inhibit, Inhibitor
Field of Research
Cell Biology, Epigenetics & Chromatin, Molecular Biology
Purity
95.85% (May vary between batches)
Solubility
DMSO:3.11 mg/mL (10.02 mM)
Smiles
Cc1ccsc1C (=O) N\N=C\c1ccc2ccccc2c1O
Molecular Formula
C17H14N2O2S
Molecular Weight
310.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Pcna-I1
CAS Number444930-42-1
PubChem CID135533619
IUPAC NameN-[(E)-(1-hydroxynaphthalen-2-yl)methylideneamino]-3-methylthiophene-2-carboxamide
Molecular FormulaC17H14N2O2S
Molecular Weight310.4
XLogP4.1
Topological Polar Surface Area89.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity429
SMILES
CC1=C(SC=C1)C(=O)N/N=C/C2=C(C3=CC=CC=C3C=C2)O
InChI
InChI=1S/C17H14N2O2S/c1-11-8-9-22-16(11)17(21)19-18-10-13-7-6-12-4-2-3-5-14(12)15(13)20/h2-10,20H,1H3,(H,19,21)/b18-10+
InChIKey
NZWTWRNHYZNWNW-VCHYOVAHSA-N
Chemical Structure
2D Structure
2D structure of Pcna-I1
CAS: 444930-42-1
CID: 135533619
Formula: C17H14N2O2S
MW: 310.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight310.4
XLogP34.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass310.07759887
Monoisotopic Mass310.07759887
Topological Polar Surface Area89.9 Ų
Heavy Atom Count22
Formal Charge0
Complexity429
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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