4927-0050 Screening compound: N-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1-cyclopropanecarboxamide

4927-0050 Screening compound: N-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1-cyclopropanecarboxamide
4927-0050 Screening compound: N-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1-cyclopropanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4927-0050
N-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1-cyclopropanecarboxamide

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

4927-0050

Molecular Formula

C18H18N2O3S (C18 H18 N2 O3 S)

Compound Name

N-[4-(2,3-dihydro-1H-indol-1-ylsulfonyl)phenyl]-1-cyclopropanecarboxamide

IUPAC name

N-[4-(23-dihydro-1H-indole-1-sulfonyl)phenyl]cyclopropanecarboxamide

SMILES

O=C(C1CC1)Nc(cc1)ccc1S(N(CC1)c2c1cccc2)(=O)=O

InChI

InChI=1S/C18H18N2O3S/c21-18(14-5-6-14)19-15-7-9-16(10-8-15)24(22,23)20-12-11-13-3-1-2-4-17(13)20/h1-4,7-10,14H,5-6,11-12H2,(H,19,21)

InChI Key

ARJYDVSKWGDFJB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03129345

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.987

Distribution Coefficient, logD

2.986

Water Solubility, LogSw

-3.63

Polar Surface Area

55.371

Acid Dissociation Constant (pKa)

10.73

Base Dissociation Constant (pKb)

-0.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.78

4927-0050 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4927-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4927-0050?
Check Price and Availability of 4927-0050, 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 4927-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4927-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4927-0050
  • 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 4927-0050 available by request