G849-0112 Screening compound: 3-(1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-[4-(trifluoromethoxy)phenyl]propanamide

G849-0112 Screening compound: 3-(1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-[4-(trifluoromethoxy)phenyl]propanamide
G849-0112 Screening compound: 3-(1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-[4-(trifluoromethoxy)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G849-0112
3-(1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-[4-(trifluoromethoxy)phenyl]propanamide

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

G849-0112

Molecular Formula

C22H22F3N3O5S (C22 H22 F3 N3 O5 S)

Compound Name

3-(1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-5-sulfonamido)-N-[4-(trifluoromethoxy)phenyl]propanamide

IUPAC name

3-(1-cyclopropanecarbonyl-23-dihydro-1H-indole-5-sulfonamido)-N-[4-(trifluoromethoxy)phenyl]propanamide

SMILES

O=C(CCNS(c(cc1)cc(CC2)c1N2C(C1CC1)=O)(=O)=O)Nc(cc1)ccc1OC(F)(F)F

InChI

InChI=1S/C22H22F3N3O5S/c23-22(24,25)33-17-5-3-16(4-6-17)27-20(29)9-11-26-34(31,32)18-7-8-19-15(13-18)10-12-28(19)21(30)14-1-2-14/h3-8,13-14,26H,1-2,9-12H2,(H,27,29)

InChI Key

SBXPROARUMSVBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15040173

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.878

Distribution Coefficient, logD

3.877

Water Solubility, LogSw

-4.19

Polar Surface Area

87.126

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

0.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

G849-0112 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G849-0112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G849-0112?
Check Price and Availability of G849-0112, 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 G849-0112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G849-0112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G849-0112
  • 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 G849-0112 available by request