D245-0275 Screening compound: ethyl 1-[2-(4-methoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate

D245-0275 Screening compound: ethyl 1-[2-(4-methoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate
D245-0275 Screening compound: ethyl 1-[2-(4-methoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound D245-0275
ethyl 1-[2-(4-methoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate

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

D245-0275

Molecular Formula

C21H25N5O3 (C21 H25 N5 O3)

Compound Name

ethyl 1-[2-(4-methoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[2-(4-methoxyphenyl)-5-methyl-[124]triazolo[15-a]pyrimidin-7-yl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1c1cc(C)nc2nc(-c(cc3)ccc3OC)nn12)=O

InChI

InChI=1S/C21H25N5O3/c1-4-29-20(27)16-9-11-25(12-10-16)18-13-14(2)22-21-23-19(24-26(18)21)15-5-7-17(28-3)8-6-15/h5-8,13,16H,4,9-12H2,1-3H3

InChI Key

XLQYSCMWBQWXNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14815260

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.702

Distribution Coefficient, logD

3.478

Water Solubility, LogSw

-3.84

Polar Surface Area

61.415

Acid Dissociation Constant (pKa)

22.84

Base Dissociation Constant (pKb)

7.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

D245-0275 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Purinergic Library (3321 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cardiovascular
  • Metabolic
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D245-0275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D245-0275?
Check Price and Availability of D245-0275, 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 D245-0275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D245-0275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D245-0275
  • 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 D245-0275 available by request