P814-5372 Screening compound: N-cyclohexyl-3-(7-methyl-8-oxo-8,9-dihydro-7H-purin-9-yl)pyrrolidine-1-carboxamide

P814-5372 Screening compound: N-cyclohexyl-3-(7-methyl-8-oxo-8,9-dihydro-7H-purin-9-yl)pyrrolidine-1-carboxamide
P814-5372 Screening compound: N-cyclohexyl-3-(7-methyl-8-oxo-8,9-dihydro-7H-purin-9-yl)pyrrolidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P814-5372
N-cyclohexyl-3-(7-methyl-8-oxo-8,9-dihydro-7H-purin-9-yl)pyrrolidine-1-carboxamide

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

P814-5372

Molecular Formula

C17H24N6O2 (C17 H24 N6 O2)

Compound Name

N-cyclohexyl-3-(7-methyl-8-oxo-8,9-dihydro-7H-purin-9-yl)pyrrolidine-1-carboxamide

IUPAC name

N-cyclohexyl-3-(7-methyl-8-oxo-89-dihydro-7H-purin-9-yl)pyrrolidine-1-carboxamide

SMILES

CN(c1c(N2C(CC3)CN3C(NC3CCCCC3)=O)ncnc1)C2=O

InChI

InChI=1S/C17H24N6O2/c1-21-14-9-18-11-19-15(14)23(17(21)25)13-7-8-22(10-13)16(24)20-12-5-3-2-4-6-12/h9,11-13H,2-8,10H2,1H3,(H,20,24)/t13-/m0/s1

InChI Key

IMZRYIFFMIGZOQ-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD29030128

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.753

Distribution Coefficient, logD

1.753

Water Solubility, LogSw

-2.15

Polar Surface Area

65.294

Acid Dissociation Constant (pKa)

16.99

Base Dissociation Constant (pKb)

3.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.70

P814-5372 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Bcl2-PPI Inhibitors Library (12246 compounds)

CNS MPO Library (28609 compounds)

GPCR Targeted Library (31838 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Soluble Diversity Library (15920 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Hemic and lymphatic
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases
  • GPCR
  • Others
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with P814-5372 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P814-5372?
Check Price and Availability of P814-5372, 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 P814-5372 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P814-5372
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P814-5372
  • 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 P814-5372 available by request