D308-0331 Screening compound: N-(2-ethylphenyl)-2-{[1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl}acetamide

D308-0331 Screening compound: N-(2-ethylphenyl)-2-{[1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl}acetamide
D308-0331 Screening compound: N-(2-ethylphenyl)-2-{[1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D308-0331
N-(2-ethylphenyl)-2-{[1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl}acetamide

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

D308-0331

Molecular Formula

C20H18N4OS (C20 H18 N4 OS)

Compound Name

N-(2-ethylphenyl)-2-{[1,2,4]triazolo[4,3-a]quinolin-1-ylsulfanyl}acetamide

IUPAC name

N-(2-ethylphenyl)-2-{[124]triazolo[43-a]quinolin-1-ylsulfanyl}acetamide

SMILES

CCc(cccc1)c1NC(CSc1nnc2n1c(cccc1)c1cc2)=O

InChI

InChI=1S/C20H18N4OS/c1-2-14-7-3-5-9-16(14)21-19(25)13-26-20-23-22-18-12-11-15-8-4-6-10-17(15)24(18)20/h3-12H,2,13H2,1H3,(H,21,25)

InChI Key

BFENUUYRMCXJLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06488594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.955

Distribution Coefficient, logD

3.955

Water Solubility, LogSw

-4.10

Polar Surface Area

43.533

Acid Dissociation Constant (pKa)

13.03

Base Dissociation Constant (pKb)

2.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

D308-0331 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D308-0331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D308-0331?
Check Price and Availability of D308-0331, 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 D308-0331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D308-0331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D308-0331
  • 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 D308-0331 available by request