G414-0079 Screening compound: N6-(1-benzylpiperidin-4-yl)-N4-(4-chlorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine

G414-0079 Screening compound: N6-(1-benzylpiperidin-4-yl)-N4-(4-chlorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
G414-0079 Screening compound: N6-(1-benzylpiperidin-4-yl)-N4-(4-chlorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound G414-0079
N6-(1-benzylpiperidin-4-yl)-N4-(4-chlorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine

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

G414-0079

Molecular Formula

C24H26ClN7 (C24 H26 ClN7)

Compound Name

N6-(1-benzylpiperidin-4-yl)-N4-(4-chlorophenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine

IUPAC name

N6-(1-benzylpiperidin-4-yl)-N4-(4-chlorophenyl)-1-methyl-1H-pyrazolo[34-d]pyrimidine-46-diamine

SMILES

Cn1ncc2c1nc(NC1CCN(Cc3ccccc3)CC1)nc2Nc(cc1)ccc1Cl

InChI

InChI=1S/C24H26ClN7/c1-31-23-21(15-26-31)22(27-19-9-7-18(25)8-10-19)29-24(30-23)28-20-11-13-32(14-12-20)16-17-5-3-2-4-6-17/h2-10,15,20H,11-14,16H2,1H3,(H2,27,28,29,30)

InChI Key

XIVKMBAZSKVCHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27139810

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.97

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.850

Distribution Coefficient, logD

4.087

Water Solubility, LogSw

-4.79

Polar Surface Area

57.845

Acid Dissociation Constant (pKa)

15.44

Base Dissociation Constant (pKb)

8.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

G414-0079 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G414-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G414-0079?
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What is the minimum amount of G414-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G414-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G414-0079
  • 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 G414-0079 available by request