G414-0577 Screening compound: 2-[(4-{[(2-chlorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]ethan-1-ol

G414-0577 Screening compound: 2-[(4-{[(2-chlorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]ethan-1-ol
G414-0577 Screening compound: 2-[(4-{[(2-chlorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound G414-0577
2-[(4-{[(2-chlorophenyl)methyl]amino}-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)amino]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

G414-0577

Molecular Formula

C15H17ClN6O (C15 H17 ClN6 O)

Compound Name

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

IUPAC name

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

SMILES

Cn1ncc2c1nc(NCCO)nc2NCc(cccc1)c1Cl

InChI

InChI=1S/C15H17ClN6O/c1-22-14-11(9-19-22)13(20-15(21-14)17-6-7-23)18-8-10-4-2-3-5-12(10)16/h2-5,9,23H,6-8H2,1H3,(H2,17,18,20,21)

InChI Key

QFNKFTDYZZRFTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27139922

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

332.79

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.209

Distribution Coefficient, logD

2.148

Water Solubility, LogSw

-2.67

Polar Surface Area

72.670

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

6.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

G414-0577 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with G414-0577 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G414-0577?
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What is the minimum amount of G414-0577 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G414-0577
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G414-0577
  • 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 G414-0577 available by request