D245-0113 Screening compound: N-(2,4-dimethoxyphenyl)-5-methyl-2-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

D245-0113 Screening compound: N-(2,4-dimethoxyphenyl)-5-methyl-2-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
D245-0113 Screening compound: N-(2,4-dimethoxyphenyl)-5-methyl-2-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D245-0113
N-(2,4-dimethoxyphenyl)-5-methyl-2-(4-methylphenyl)-[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

D245-0113

Molecular Formula

C21H21N5O2 (C21 H21 N5 O2)

Compound Name

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

IUPAC name

N-(24-dimethoxyphenyl)-5-methyl-2-(4-methylphenyl)-[124]triazolo[15-a]pyrimidin-7-amine

SMILES

Cc(cc1)ccc1-c1nn2c(Nc(ccc(OC)c3)c3OC)cc(C)nc2n1

InChI

InChI=1S/C21H21N5O2/c1-13-5-7-15(8-6-13)20-24-21-22-14(2)11-19(26(21)25-20)23-17-10-9-16(27-3)12-18(17)28-4/h5-12,23H,1-4H3

InChI Key

KTHFHOUDWFFLSU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14815136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.578

Distribution Coefficient, logD

4.563

Water Solubility, LogSw

-4.35

Polar Surface Area

54.317

Acid Dissociation Constant (pKa)

15.50

Base Dissociation Constant (pKb)

5.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

D245-0113 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D245-0113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D245-0113?
Check Price and Availability of D245-0113, 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 D245-0113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D245-0113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D245-0113
  • 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 D245-0113 available by request