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R306465

CAT: 0931-T21324-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T21324-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
604769-01-9
Target
Apoptosis, HDAC
Related Pathways
Chromatin/Epigenetic, DNA Damage/DNA Repair, Apoptosis
Purity
0.9964
Bioactivity
R306465 (JNJ-16241199) is an orally active and selective class I histone deacetylase (HDAC 1) inhibitor with an IC50 of 3.3 nM. R306465 has a broad spectrum of antitumor activity, can induce histone 3 acetylation, and induce apoptosis, and can be used to study solid tumors and hematological malignancies.
Smiles
O=C(NO)C1=CN=C(N=C1)N2CCN(CC2)S(=O)(=O)C=3C=CC=4C=CC=CC4C3
Molecular Formula
C19H19N5O4S
Molecular Weight
413.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

R-306465

R306465 has been used in trials studying the treatment of Neoplasms.

CAS Number604769-01-9
PubChem CID10309899
IUPAC NameN-hydroxy-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine-5-carboxamide
Molecular FormulaC19H19N5O4S
Molecular Weight413.5
XLogP1.3
Topological Polar Surface Area124
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity669
SMILES
C1CN(CCN1C2=NC=C(C=N2)C(=O)NO)S(=O)(=O)C3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C19H19N5O4S/c25-18(22-26)16-12-20-19(21-13-16)23-7-9-24(10-8-23)29(27,28)17-6-5-14-3-1-2-4-15(14)11-17/h1-6,11-13,26H,7-10H2,(H,22,25)
InChIKey
MUTBJZVSRNUIHA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of R-306465
CAS: 604769-01-9
CID: 10309899
Formula: C19H19N5O4S
MW: 413.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight413.5
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass413.11577528
Monoisotopic Mass413.11577528
Topological Polar Surface Area124 Ų
Heavy Atom Count29
Formal Charge0
Complexity669
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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A15437-10R306465 10mg
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A15437-2R306465 2mg

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