P814-6365 Screening compound: N-CYCLOPENTYL-N'-[2-(8-OXO-7,8-DIHYDRO-9H-PURIN-9-YL)ETHYL]UREA

P814-6365 Screening compound: N-CYCLOPENTYL-N'-[2-(8-OXO-7,8-DIHYDRO-9H-PURIN-9-YL)ETHYL]UREA
P814-6365 Screening compound: N-CYCLOPENTYL-N'-[2-(8-OXO-7,8-DIHYDRO-9H-PURIN-9-YL)ETHYL]UREA alternative view

Chemical Structure Depiction of ChemDiv screening compound P814-6365
N-CYCLOPENTYL-N'-[2-(8-OXO-7,8-DIHYDRO-9H-PURIN-9-YL)ETHYL]UREA

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

P814-6365

Molecular Formula

C13H18N6O2 (C13 H18 N6 O2)

Compound Name

N-CYCLOPENTYL-N'-[2-(8-OXO-7,8-DIHYDRO-9H-PURIN-9-YL)ETHYL]UREA

IUPAC name

1-cyclopentyl-3-[2-(8-oxo-89-dihydro-7H-purin-9-yl)ethyl]urea

SMILES

O=C(NCCN(c(ncnc1)c1N1)C1=O)NC1CCCC1

InChI

InChI=1S/C13H18N6O2/c20-12(17-9-3-1-2-4-9)15-5-6-19-11-10(18-13(19)21)7-14-8-16-11/h7-9H,1-6H2,(H,18,21)(H2,15,17,20)

InChI Key

HGCZMMQMJUKMDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030235

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.765

Distribution Coefficient, logD

0.764

Water Solubility, LogSw

-1.71

Polar Surface Area

83.755

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.85

P814-6365 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Bcl2-PPI Inhibitors Library (12246 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Nucleoside Mimetics Library (2197 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Purine Based Nucleoside Mimetics Library (1131 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Hemic and lymphatic
  • Antiviral
  • Infections
  • Cancer
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Kinases
  • Others
Mechanism of action:
  • PPI modulators
  • Epigenetic
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with P814-6365 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P814-6365?
Check Price and Availability of P814-6365, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of P814-6365 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P814-6365
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P814-6365
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of P814-6365 available by request