D283-0078 Screening compound: 3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(quinolin-3-yl)propanamide

D283-0078 Screening compound: 3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(quinolin-3-yl)propanamide
D283-0078 Screening compound: 3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(quinolin-3-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D283-0078
3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(quinolin-3-yl)propanamide

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

D283-0078

Molecular Formula

C19H18N6O (C19 H18 N6 O)

Compound Name

3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}-N-(quinolin-3-yl)propanamide

IUPAC name

3-{57-dimethyl-[124]triazolo[15-a]pyrimidin-6-yl}-N-(quinolin-3-yl)propanamide

SMILES

Cc1c(CCC(Nc2cc3ccccc3nc2)=O)c(C)nc2ncnn12

InChI

InChI=1S/C19H18N6O/c1-12-16(13(2)25-19(23-12)21-11-22-25)7-8-18(26)24-15-9-14-5-3-4-6-17(14)20-10-15/h3-6,9-11H,7-8H2,1-2H3,(H,24,26)

InChI Key

DKKXSVIBVRVDSQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10893798

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.994

Distribution Coefficient, logD

1.993

Water Solubility, LogSw

-2.81

Polar Surface Area

64.047

Acid Dissociation Constant (pKa)

12.04

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D283-0078 in Drug Discovery

Included in Screening Libraries

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

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D283-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D283-0078?
Check Price and Availability of D283-0078, 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 D283-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D283-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D283-0078
  • 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 D283-0078 available by request