8017-9245 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N,N-diethyl-2-oxoacetamide

8017-9245 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N,N-diethyl-2-oxoacetamide
8017-9245 Screening compound: 2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N,N-diethyl-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9245
2-{1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}-N,N-diethyl-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

8017-9245

Molecular Formula

C21H21ClN2O2 (C21 H21 ClN2 O2)

Compound Name

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

IUPAC name

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

SMILES

CCN(CC)C(C(c1cn(Cc(cccc2)c2Cl)c2c1cccc2)=O)=O

InChI

InChI=1S/C21H21ClN2O2/c1-3-23(4-2)21(26)20(25)17-14-24(19-12-8-6-10-16(17)19)13-15-9-5-7-11-18(15)22/h5-12,14H,3-4,13H2,1-2H3

InChI Key

PHWAWUHTKZUMDA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05844369

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.86

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.164

Distribution Coefficient, logD

4.164

Water Solubility, LogSw

-4.40

Polar Surface Area

31.641

Acid Dissociation Constant (pKa)

27.27

Base Dissociation Constant (pKb)

2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

8017-9245 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

Antiviral Library (67538 compounds)

Anti-HIV1 Library (19540 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

References: we are preparing a list of scientific research reports with 8017-9245 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9245?
Check Price and Availability of 8017-9245, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8017-9245 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9245
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9245
  • 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 8017-9245 available by request