V030-4947 Screening compound: 2-(4-CHLOROPHENYL)-4-(3,4-DIMETHOXYPHENYL)-N6-[2-(DIMETHYLAMINO)ETHYL]-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE

V030-4947 Screening compound: 2-(4-CHLOROPHENYL)-4-(3,4-DIMETHOXYPHENYL)-N6-[2-(DIMETHYLAMINO)ETHYL]-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE
V030-4947 Screening compound: 2-(4-CHLOROPHENYL)-4-(3,4-DIMETHOXYPHENYL)-N6-[2-(DIMETHYLAMINO)ETHYL]-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-4947
2-(4-CHLOROPHENYL)-4-(3,4-DIMETHOXYPHENYL)-N6-[2-(DIMETHYLAMINO)ETHYL]-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-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

V030-4947

Molecular Formula

C23H26ClN7O2 (C23 H26 ClN7 O2)

Compound Name

2-(4-CHLOROPHENYL)-4-(3,4-DIMETHOXYPHENYL)-N6-[2-(DIMETHYLAMINO)ETHYL]-2H-PYRAZOLO[3,4-D]PYRIMIDINE-3,6-DIAMINE

IUPAC name

2-(4-chlorophenyl)-4-(34-dimethoxyphenyl)-N6-[2-(dimethylamino)ethyl]-2H-pyrazolo[34-d]pyrimidine-36-diamine

SMILES

CN(C)CCNc(nc(c1c2N)-c(cc3)cc(OC)c3OC)nc1nn2-c(cc1)ccc1Cl

InChI

InChI=1S/C23H26ClN7O2/c1-30(2)12-11-26-23-27-20(14-5-10-17(32-3)18(13-14)33-4)19-21(25)31(29-22(19)28-23)16-8-6-15(24)7-9-16/h5-10,13H,11-12,25H2,1-4H3,(H,26,28,29)

InChI Key

SKIXEJNLCOBTOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20500454

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.641

Distribution Coefficient, logD

2.022

Water Solubility, LogSw

-4.31

Polar Surface Area

84.050

Acid Dissociation Constant (pKa)

17.85

Base Dissociation Constant (pKb)

9.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

V030-4947 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V030-4947 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-4947?
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What is the minimum amount of V030-4947 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-4947
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-4947
  • 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 V030-4947 available by request