G366-0048 Screening compound: 1-acetyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-indole-2-carboxamide

G366-0048 Screening compound: 1-acetyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-indole-2-carboxamide
G366-0048 Screening compound: 1-acetyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G366-0048
1-acetyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-indole-2-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

G366-0048

Molecular Formula

C18H15F3N2O2 (C18 H15 F3 N2 O2)

Compound Name

1-acetyl-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-indole-2-carboxamide

IUPAC name

1-acetyl-N-[3-(trifluoromethyl)phenyl]-23-dihydro-1H-indole-2-carboxamide

SMILES

CC(N(C(C1)C(Nc2cccc(C(F)(F)F)c2)=O)c2c1cccc2)=O

InChI

InChI=1S/C18H15F3N2O2/c1-11(24)23-15-8-3-2-5-12(15)9-16(23)17(25)22-14-7-4-6-13(10-14)18(19,20)21/h2-8,10,16H,9H2,1H3,(H,22,25)

InChI Key

YOMQCGQAEPZDHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15004068

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.490

Distribution Coefficient, logD

3.484

Water Solubility, LogSw

-3.81

Polar Surface Area

39.096

Acid Dissociation Constant (pKa)

9.25

Base Dissociation Constant (pKb)

-1.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

G366-0048 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G366-0048 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G366-0048?
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What is the minimum amount of G366-0048 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G366-0048
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G366-0048
  • 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 G366-0048 available by request