G414-0526 Screening compound: 3-{[4-(benzylamino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol

G414-0526 Screening compound: 3-{[4-(benzylamino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol
G414-0526 Screening compound: 3-{[4-(benzylamino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound G414-0526
3-{[4-(benzylamino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol

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

G414-0526

Molecular Formula

C16H20N6O (C16 H20 N6 O)

Compound Name

3-{[4-(benzylamino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]amino}propan-1-ol

IUPAC name

3-{[4-(benzylamino)-1-methyl-1H-pyrazolo[34-d]pyrimidin-6-yl]amino}propan-1-ol

SMILES

Cn1ncc2c(NCc3ccccc3)nc(NCCCO)nc12

InChI

InChI=1S/C16H20N6O/c1-22-15-13(11-19-22)14(18-10-12-6-3-2-4-7-12)20-16(21-15)17-8-5-9-23/h2-4,6-7,11,23H,5,8-10H2,1H3,(H2,17,18,20,21)

InChI Key

NFLNSLVNNJNFBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07190488

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

312.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.411

Distribution Coefficient, logD

1.378

Water Solubility, LogSw

-1.12

Polar Surface Area

72.670

Acid Dissociation Constant (pKa)

15.57

Base Dissociation Constant (pKb)

6.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

G414-0526 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
Mechanism of action:
  • Epigenetic
Structure:
  • Pool

References: we are preparing a list of scientific research reports with G414-0526 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G414-0526?
Check Price and Availability of G414-0526, 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 G414-0526 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G414-0526
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G414-0526
  • 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 G414-0526 available by request