V026-4082 Screening compound: 3-ethyl-1-(2-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)urea

V026-4082 Screening compound: 3-ethyl-1-(2-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)urea
V026-4082 Screening compound: 3-ethyl-1-(2-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-4082
3-ethyl-1-(2-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}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

V026-4082

Molecular Formula

C20H27N7O2 (C20 H27 N7 O2)

Compound Name

3-ethyl-1-(2-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)urea

IUPAC name

3-ethyl-1-(2-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[34-d]pyrimidin-4-yl]amino}ethyl)urea

SMILES

CCNC(NCCNc1nc(COC)nc2c1c(C)nn2-c1ccc(C)cc1)=O

InChI

InChI=1S/C20H27N7O2/c1-5-21-20(28)23-11-10-22-18-17-14(3)26-27(15-8-6-13(2)7-9-15)19(17)25-16(24-18)12-29-4/h6-9H,5,10-12H2,1-4H3,(H2,21,23,28)(H,22,24,25)

InChI Key

WZXFWGOBSMQEPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14257803

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

397.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.910

Distribution Coefficient, logD

1.825

Water Solubility, LogSw

-2.58

Polar Surface Area

88.677

Acid Dissociation Constant (pKa)

16.08

Base Dissociation Constant (pKb)

6.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V026-4082 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V026-4082 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-4082?
Check Price and Availability of V026-4082, 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 V026-4082 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-4082
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-4082
  • 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 V026-4082 available by request