D278-0805 Screening compound: N-(3-acetylphenyl)-2-({9-methoxy-5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamide

D278-0805 Screening compound: N-(3-acetylphenyl)-2-({9-methoxy-5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamide
D278-0805 Screening compound: N-(3-acetylphenyl)-2-({9-methoxy-5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D278-0805
N-(3-acetylphenyl)-2-({9-methoxy-5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)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

D278-0805

Molecular Formula

C22H20N4O3S (C22 H20 N4 O3 S)

Compound Name

N-(3-acetylphenyl)-2-({9-methoxy-5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)acetamide

IUPAC name

N-(3-acetylphenyl)-2-({9-methoxy-5-methyl-[124]triazolo[43-a]quinolin-1-yl}sulfanyl)acetamide

SMILES

CC(c1cccc(NC(CSc2nnc(cc(C)c3ccc4)n2c3c4OC)=O)c1)=O

InChI

InChI=1S/C22H20N4O3S/c1-13-10-19-24-25-22(26(19)21-17(13)8-5-9-18(21)29-3)30-12-20(28)23-16-7-4-6-15(11-16)14(2)27/h4-11H,12H2,1-3H3,(H,23,28)

InChI Key

TXJJOIIWXBBZJF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06443617

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.690

Distribution Coefficient, logD

3.690

Water Solubility, LogSw

-4.18

Polar Surface Area

65.464

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

2.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

D278-0805 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D278-0805 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D278-0805?
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What is the minimum amount of D278-0805 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D278-0805
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D278-0805
  • 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 D278-0805 available by request