V031-0019 Screening compound: 6-benzyl-5-methyl-N-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

V031-0019 Screening compound: 6-benzyl-5-methyl-N-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
V031-0019 Screening compound: 6-benzyl-5-methyl-N-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-0019
6-benzyl-5-methyl-N-[(3-methylphenyl)methyl]-[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

V031-0019

Molecular Formula

C21H21N5 (C21 H21 N5)

Compound Name

6-benzyl-5-methyl-N-[(3-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

IUPAC name

6-benzyl-5-methyl-N-[(3-methylphenyl)methyl]-[124]triazolo[15-a]pyrimidin-7-amine

SMILES

Cc1cccc(CNc2c(Cc3ccccc3)c(C)nc3ncnn23)c1

InChI

InChI=1S/C21H21N5/c1-15-7-6-10-18(11-15)13-22-20-19(12-17-8-4-3-5-9-17)16(2)25-21-23-14-24-26(20)21/h3-11,14,22H,12-13H2,1-2H3

InChI Key

GUFBFDBAZBGJED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19956810

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

343.43

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.155

Distribution Coefficient, logD

4.144

Water Solubility, LogSw

-4.39

Polar Surface Area

41.952

Acid Dissociation Constant (pKa)

15.47

Base Dissociation Constant (pKb)

5.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

V031-0019 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antifungal Library (16415 compounds)

Immunological Library (6760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V031-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-0019?
Check Price and Availability of V031-0019, 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 V031-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-0019
  • 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 V031-0019 available by request