C730-0378 Screening compound: 2-(2-methyl-1H-indol-3-yl)-2-oxo-N-[4-(trifluoromethoxy)phenyl]acetamide

C730-0378 Screening compound: 2-(2-methyl-1H-indol-3-yl)-2-oxo-N-[4-(trifluoromethoxy)phenyl]acetamide
C730-0378 Screening compound: 2-(2-methyl-1H-indol-3-yl)-2-oxo-N-[4-(trifluoromethoxy)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C730-0378
2-(2-methyl-1H-indol-3-yl)-2-oxo-N-[4-(trifluoromethoxy)phenyl]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

C730-0378

Molecular Formula

C18H13F3N2O3 (C18 H13 F3 N2 O3)

Compound Name

2-(2-methyl-1H-indol-3-yl)-2-oxo-N-[4-(trifluoromethoxy)phenyl]acetamide

IUPAC name

2-(2-methyl-1H-indol-3-yl)-2-oxo-N-[4-(trifluoromethoxy)phenyl]acetamide

SMILES

Cc1c(C(C(Nc(cc2)ccc2OC(F)(F)F)=O)=O)c(cccc2)c2[nH]1

InChI

InChI=1S/C18H13F3N2O3/c1-10-15(13-4-2-3-5-14(13)22-10)16(24)17(25)23-11-6-8-12(9-7-11)26-18(19,20)21/h2-9,22H,1H3,(H,23,25)

InChI Key

HAUUCXWYYNVAMC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05714617

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.552

Distribution Coefficient, logD

4.550

Water Solubility, LogSw

-4.56

Polar Surface Area

52.931

Acid Dissociation Constant (pKa)

9.60

Base Dissociation Constant (pKb)

3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

C730-0378 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with C730-0378 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C730-0378?
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What is the minimum amount of C730-0378 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C730-0378
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C730-0378
  • 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 C730-0378 available by request