F019-0180 Screening compound: N-(3-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

F019-0180 Screening compound: N-(3-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
F019-0180 Screening compound: N-(3-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F019-0180
N-(3-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-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

F019-0180

Molecular Formula

C24H20Cl2N4O2S (C24 H20 Cl2 N4 O2 S)

Compound Name

N-(3-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

IUPAC name

N-(3-chloro-2-methylphenyl)-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-124-triazol-3-yl]sulfanyl}acetamide

SMILES

Cc(c(NC(CSc1nnc(-c(cc2)ccc2OC)n1-c(cc1)ccc1Cl)=O)ccc1)c1Cl

InChI

InChI=1S/C24H20Cl2N4O2S/c1-15-20(26)4-3-5-21(15)27-22(31)14-33-24-29-28-23(16-6-12-19(32-2)13-7-16)30(24)18-10-8-17(25)9-11-18/h3-13H,14H2,1-2H3,(H,27,31)

InChI Key

HCALPOICIBBHFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03223265

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.172

Distribution Coefficient, logD

6.172

Water Solubility, LogSw

-6.14

Polar Surface Area

54.708

Acid Dissociation Constant (pKa)

10.77

Base Dissociation Constant (pKb)

2.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

F019-0180 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
  • Nervous system
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with F019-0180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F019-0180?
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What is the minimum amount of F019-0180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F019-0180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F019-0180
  • 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 F019-0180 available by request