D038-0105 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(5-methyl-1-benzofuran-3-yl)acetamide

D038-0105 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(5-methyl-1-benzofuran-3-yl)acetamide
D038-0105 Screening compound: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(5-methyl-1-benzofuran-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D038-0105
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(5-methyl-1-benzofuran-3-yl)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

D038-0105

Molecular Formula

C18H13ClF3NO2 (C18 H13 ClF3 NO2)

Compound Name

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(5-methyl-1-benzofuran-3-yl)acetamide

IUPAC name

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(5-methyl-1-benzofuran-3-yl)acetamide

SMILES

Cc(cc1)cc2c1occ2CC(Nc(cc(C(F)(F)F)cc1)c1Cl)=O

InChI

InChI=1S/C18H13ClF3NO2/c1-10-2-5-16-13(6-10)11(9-25-16)7-17(24)23-15-8-12(18(20,21)22)3-4-14(15)19/h2-6,8-9H,7H2,1H3,(H,23,24)

InChI Key

OLGPLZUONGAPPI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06626330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.75

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.047

Distribution Coefficient, logD

4.932

Water Solubility, LogSw

-5.26

Polar Surface Area

31.978

Acid Dissociation Constant (pKa)

7.92

Base Dissociation Constant (pKb)

-1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

D038-0105 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D038-0105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D038-0105?
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What is the minimum amount of D038-0105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D038-0105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D038-0105
  • 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 D038-0105 available by request