P097-0100 Screening compound: 1-methyl-2-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-2,3-dihydro-1H-indole-5-carboxamide

P097-0100 Screening compound: 1-methyl-2-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-2,3-dihydro-1H-indole-5-carboxamide
P097-0100 Screening compound: 1-methyl-2-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-2,3-dihydro-1H-indole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P097-0100
1-methyl-2-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-2,3-dihydro-1H-indole-5-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

P097-0100

Molecular Formula

C18H15F3N2O2 (C18 H15 F3 N2 O2)

Compound Name

1-methyl-2-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-2,3-dihydro-1H-indole-5-carboxamide

IUPAC name

1-methyl-2-oxo-N-{[2-(trifluoromethyl)phenyl]methyl}-23-dihydro-1H-indole-5-carboxamide

SMILES

CN(C(C1)=O)c(cc2)c1cc2C(NCc1c(C(F)(F)F)cccc1)=O

InChI

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

InChI Key

FGKGKTAIJKXLHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27564299

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

2.985

Distribution Coefficient, logD

2.985

Water Solubility, LogSw

-3.67

Polar Surface Area

40.435

Acid Dissociation Constant (pKa)

10.51

Base Dissociation Constant (pKb)

-2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

P097-0100 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Hsp90-Targeted Library (11355 compounds)

STING Agonist Library (5895 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Immune system
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P097-0100 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P097-0100?
Check Price and Availability of P097-0100, 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 P097-0100 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P097-0100
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P097-0100
  • 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 P097-0100 available by request