D245-0191 Screening compound: 2-(4-tert-butylphenyl)-5-methyl-N-(propan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

D245-0191 Screening compound: 2-(4-tert-butylphenyl)-5-methyl-N-(propan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
D245-0191 Screening compound: 2-(4-tert-butylphenyl)-5-methyl-N-(propan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D245-0191
2-(4-tert-butylphenyl)-5-methyl-N-(propan-2-yl)-[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

D245-0191

Molecular Formula

C19H25N5 (C19 H25 N5)

Compound Name

2-(4-tert-butylphenyl)-5-methyl-N-(propan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

IUPAC name

2-(4-tert-butylphenyl)-5-methyl-N-(propan-2-yl)-[124]triazolo[15-a]pyrimidin-7-amine

SMILES

CC(C)Nc1cc(C)nc2nc(-c3ccc(C(C)(C)C)cc3)nn12

InChI

InChI=1S/C19H25N5/c1-12(2)20-16-11-13(3)21-18-22-17(23-24(16)18)14-7-9-15(10-8-14)19(4,5)6/h7-12,20H,1-6H3

InChI Key

QYLUIINSCLYSAE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14815188

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.44

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.896

Distribution Coefficient, logD

4.838

Water Solubility, LogSw

-4.58

Polar Surface Area

40.408

Acid Dissociation Constant (pKa)

17.93

Base Dissociation Constant (pKb)

6.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

D245-0191 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D245-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D245-0191?
Check Price and Availability of D245-0191, 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 D245-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D245-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D245-0191
  • 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 D245-0191 available by request