G414-1057 Screening compound: 2-[4-(4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]ethan-1-ol

G414-1057 Screening compound: 2-[4-(4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]ethan-1-ol
G414-1057 Screening compound: 2-[4-(4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound G414-1057
2-[4-(4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]ethan-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

G414-1057

Molecular Formula

C19H24FN7O (C19 H24 FN7 O)

Compound Name

2-[4-(4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-yl]ethan-1-ol

IUPAC name

2-[4-(4-{[(4-fluorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[34-d]pyrimidin-6-yl)piperazin-1-yl]ethan-1-ol

SMILES

Cn1ncc2c1nc(N1CCN(CCO)CC1)nc2NCc(cc1)ccc1F

InChI

InChI=1S/C19H24FN7O/c1-25-18-16(13-22-25)17(21-12-14-2-4-15(20)5-3-14)23-19(24-18)27-8-6-26(7-9-27)10-11-28/h2-5,13,28H,6-12H2,1H3,(H,21,23,24)

InChI Key

YXGVJGVOSDODGR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27140059

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

385.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.850

Distribution Coefficient, logD

1.662

Water Solubility, LogSw

-1.61

Polar Surface Area

67.358

Acid Dissociation Constant (pKa)

14.61

Base Dissociation Constant (pKb)

7.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

G414-1057 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G414-1057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G414-1057?
Check Price and Availability of G414-1057, 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 G414-1057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G414-1057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G414-1057
  • 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 G414-1057 available by request