V023-1561 Screening compound: 4-(3-fluorophenyl)-2-(4-methoxyphenyl)-N6-[2-(4-methoxyphenyl)ethyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine

V023-1561 Screening compound: 4-(3-fluorophenyl)-2-(4-methoxyphenyl)-N6-[2-(4-methoxyphenyl)ethyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
V023-1561 Screening compound: 4-(3-fluorophenyl)-2-(4-methoxyphenyl)-N6-[2-(4-methoxyphenyl)ethyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound V023-1561
4-(3-fluorophenyl)-2-(4-methoxyphenyl)-N6-[2-(4-methoxyphenyl)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

V023-1561

Molecular Formula

C27H25FN6O2 (C27 H25 FN6 O2)

Compound Name

4-(3-fluorophenyl)-2-(4-methoxyphenyl)-N6-[2-(4-methoxyphenyl)ethyl]-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine

IUPAC name

4-(3-fluorophenyl)-2-(4-methoxyphenyl)-N6-[2-(4-methoxyphenyl)ethyl]-2H-pyrazolo[34-d]pyrimidine-36-diamine

SMILES

COc1ccc(CCNc(nc(c2c3N)-c4cccc(F)c4)nc2nn3-c(cc2)ccc2OC)cc1

InChI

InChI=1S/C27H25FN6O2/c1-35-21-10-6-17(7-11-21)14-15-30-27-31-24(18-4-3-5-19(28)16-18)23-25(29)34(33-26(23)32-27)20-8-12-22(36-2)13-9-20/h3-13,16H,14-15,29H2,1-2H3,(H,30,32,33)

InChI Key

LBLUESRKDWQMQC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14249450

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

484.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.108

Distribution Coefficient, logD

5.107

Water Solubility, LogSw

-5.35

Polar Surface Area

79.740

Acid Dissociation Constant (pKa)

18.41

Base Dissociation Constant (pKb)

4.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

V023-1561 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V023-1561 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V023-1561?
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What is the minimum amount of V023-1561 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V023-1561
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V023-1561
  • 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 V023-1561 available by request