8013-5822 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N-(2-methylphenyl)-2-oxoacetamide

8013-5822 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N-(2-methylphenyl)-2-oxoacetamide
8013-5822 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N-(2-methylphenyl)-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-5822
2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N-(2-methylphenyl)-2-oxoacetamide

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

8013-5822

Molecular Formula

C24H19ClN2O2 (C24 H19 ClN2 O2)

Compound Name

2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N-(2-methylphenyl)-2-oxoacetamide

IUPAC name

2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N-(2-methylphenyl)-2-oxoacetamide

SMILES

Cc(cccc1)c1NC(C(c1cn(Cc(cccc2)c2Cl)c2c1cccc2)=O)=O

InChI

InChI=1S/C24H19ClN2O2/c1-16-8-2-6-12-21(16)26-24(29)23(28)19-15-27(22-13-7-4-10-18(19)22)14-17-9-3-5-11-20(17)25/h2-13,15H,14H2,1H3,(H,26,29)

InChI Key

IENPJQBACDGQQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03766894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.88

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.263

Distribution Coefficient, logD

5.263

Water Solubility, LogSw

-5.56

Polar Surface Area

38.103

Acid Dissociation Constant (pKa)

10.95

Base Dissociation Constant (pKb)

-2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

8013-5822 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 8013-5822 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-5822?
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What is the minimum amount of 8013-5822 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-5822
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-5822
  • 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 8013-5822 available by request