V031-1325 Screening compound: 6-(3,4-dimethoxyphenyl)-N-[2-(3-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

V031-1325 Screening compound: 6-(3,4-dimethoxyphenyl)-N-[2-(3-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
V031-1325 Screening compound: 6-(3,4-dimethoxyphenyl)-N-[2-(3-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1325
6-(3,4-dimethoxyphenyl)-N-[2-(3-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

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

V031-1325

Molecular Formula

C22H23N5O3 (C22 H23 N5 O3)

Compound Name

6-(3,4-dimethoxyphenyl)-N-[2-(3-methoxyphenyl)ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

IUPAC name

6-(34-dimethoxyphenyl)-N-[2-(3-methoxyphenyl)ethyl]-[124]triazolo[15-a]pyrimidin-7-amine

SMILES

COc1cccc(CCNc(n2ncnc2nc2)c2-c(cc2)cc(OC)c2OC)c1

InChI

InChI=1S/C22H23N5O3/c1-28-17-6-4-5-15(11-17)9-10-23-21-18(13-24-22-25-14-26-27(21)22)16-7-8-19(29-2)20(12-16)30-3/h4-8,11-14,23H,9-10H2,1-3H3

InChI Key

TXBJJRPZBSBDON-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19959790

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

405.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.906

Distribution Coefficient, logD

2.904

Water Solubility, LogSw

-3.27

Polar Surface Area

64.543

Acid Dissociation Constant (pKa)

17.10

Base Dissociation Constant (pKb)

5.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

V031-1325 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antifungal Library (16415 compounds)

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V031-1325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1325?
Check Price and Availability of V031-1325, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V031-1325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1325
  • 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 V031-1325 available by request