C137-2385 Screening compound: 5-bromo-N-{2-[butyl(methyl)amino]ethyl}-1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-6-sulfonamide

C137-2385 Screening compound: 5-bromo-N-{2-[butyl(methyl)amino]ethyl}-1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-6-sulfonamide
C137-2385 Screening compound: 5-bromo-N-{2-[butyl(methyl)amino]ethyl}-1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C137-2385
5-bromo-N-{2-[butyl(methyl)amino]ethyl}-1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-6-sulfonamide

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

C137-2385

Molecular Formula

C19H28BrN3O3S (C19 H28 BrN3 O3 S)

Compound Name

5-bromo-N-{2-[butyl(methyl)amino]ethyl}-1-cyclopropanecarbonyl-2,3-dihydro-1H-indole-6-sulfonamide

IUPAC name

5-bromo-N-{2-[butyl(methyl)amino]ethyl}-1-cyclopropanecarbonyl-23-dihydro-1H-indole-6-sulfonamide

SMILES

CCCCN(C)CCNS(c(cc(c(CC1)c2)N1C(C1CC1)=O)c2Br)(=O)=O

InChI

InChI=1S/C19H28BrN3O3S/c1-3-4-9-22(2)11-8-21-27(25,26)18-13-17-15(12-16(18)20)7-10-23(17)19(24)14-5-6-14/h12-14,21H,3-11H2,1-2H3

InChI Key

MKHSZWVQMATDIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14721801

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.431

Distribution Coefficient, logD

2.697

Water Solubility, LogSw

-3.85

Polar Surface Area

62.384

Acid Dissociation Constant (pKa)

11.28

Base Dissociation Constant (pKb)

8.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

63.16

C137-2385 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • 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 C137-2385 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C137-2385?
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What is the minimum amount of C137-2385 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C137-2385
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C137-2385
  • 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 C137-2385 available by request