D084-0482 Screening compound: N-(2,5-dichlorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide

D084-0482 Screening compound: N-(2,5-dichlorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide
D084-0482 Screening compound: N-(2,5-dichlorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D084-0482
N-(2,5-dichlorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-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

D084-0482

Molecular Formula

C12H10Cl2N4O2S (C12 H10 Cl2 N4 O2 S)

Compound Name

N-(2,5-dichlorophenyl)-2-[(3-hydroxy-6-methyl-1,2,4-triazin-5-yl)sulfanyl]acetamide

IUPAC name

N-(25-dichlorophenyl)-2-[(3-hydroxy-6-methyl-124-triazin-5-yl)sulfanyl]acetamide

SMILES

Cc(c(SCC(Nc(cc(cc1)Cl)c1Cl)=O)n1)nnc1O

InChI

InChI=1S/C12H10Cl2N4O2S/c1-6-11(16-12(20)18-17-6)21-5-10(19)15-9-4-7(13)2-3-8(9)14/h2-4H,5H2,1H3,(H,15,19)(H,16,18,20)

InChI Key

ZQYGAMFLIZOVGM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10042259

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.21

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.936

Distribution Coefficient, logD

1.924

Water Solubility, LogSw

-2.76

Polar Surface Area

71.726

Acid Dissociation Constant (pKa)

8.95

Base Dissociation Constant (pKb)

1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

D084-0482 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

RNA-Protein Interaction Inhibitors Library (1986 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 D084-0482 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D084-0482?
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What is the minimum amount of D084-0482 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D084-0482
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D084-0482
  • 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 D084-0482 available by request