1319-0169 Screening compound: 6,8-dichloro-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

1319-0169 Screening compound: 6,8-dichloro-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide
1319-0169 Screening compound: 6,8-dichloro-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1319-0169
6,8-dichloro-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

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

1319-0169

Molecular Formula

C17H11Cl2NO3 (C17 H11 Cl2 NO3)

Compound Name

6,8-dichloro-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

IUPAC name

68-dichloro-N-(4-methylphenyl)-2-oxo-2H-chromene-3-carboxamide

SMILES

Cc(cc1)ccc1NC(C1=Cc2cc(Cl)cc(Cl)c2OC1=O)=O

InChI

InChI=1S/C17H11Cl2NO3/c1-9-2-4-12(5-3-9)20-16(21)13-7-10-6-11(18)8-14(19)15(10)23-17(13)22/h2-8H,1H3,(H,20,21)

InChI Key

NVTHFQCBDXOCQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00964401

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.18

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.668

Distribution Coefficient, logD

4.666

Water Solubility, LogSw

-4.91

Polar Surface Area

43.936

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

1319-0169 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 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 1319-0169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1319-0169?
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What is the minimum amount of 1319-0169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1319-0169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1319-0169
  • 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 1319-0169 available by request