G414-0331 Screening compound: 1-METHYL-N4-(3-METHYLPHENYL)-N6-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-PYRAZOLO[3,4-D]PYRIMIDINE-4,6-DIAMINE

G414-0331 Screening compound: 1-METHYL-N4-(3-METHYLPHENYL)-N6-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-PYRAZOLO[3,4-D]PYRIMIDINE-4,6-DIAMINE
G414-0331 Screening compound: 1-METHYL-N4-(3-METHYLPHENYL)-N6-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-PYRAZOLO[3,4-D]PYRIMIDINE-4,6-DIAMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound G414-0331
1-METHYL-N4-(3-METHYLPHENYL)-N6-[2-(PYRROLIDIN-1-YL)ETHYL]-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

G414-0331

Molecular Formula

C19H25N7 (C19 H25 N7)

Compound Name

1-METHYL-N4-(3-METHYLPHENYL)-N6-[2-(PYRROLIDIN-1-YL)ETHYL]-1H-PYRAZOLO[3,4-D]PYRIMIDINE-4,6-DIAMINE

IUPAC name

1-methyl-N4-(3-methylphenyl)-N6-[2-(pyrrolidin-1-yl)ethyl]-1H-pyrazolo[34-d]pyrimidine-46-diamine

SMILES

Cc1cccc(Nc2c(cnn3C)c3nc(NCCN3CCCC3)n2)c1

InChI

InChI=1S/C19H25N7/c1-14-6-5-7-15(12-14)22-17-16-13-21-25(2)18(16)24-19(23-17)20-8-11-26-9-3-4-10-26/h5-7,12-13H,3-4,8-11H2,1-2H3,(H2,20,22,23,24)

InChI Key

QLTNBGALPKPYEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27139857

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.45

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

3.245

Distribution Coefficient, logD

1.014

Water Solubility, LogSw

-3.07

Polar Surface Area

58.769

Acid Dissociation Constant (pKa)

17.42

Base Dissociation Constant (pKb)

9.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

G414-0331 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Others

References: we are preparing a list of scientific research reports with G414-0331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G414-0331?
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What is the minimum amount of G414-0331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G414-0331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G414-0331
  • 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 G414-0331 available by request