D348-0052 Screening compound: N-(2-bromophenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-carboxamide

D348-0052 Screening compound: N-(2-bromophenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-carboxamide
D348-0052 Screening compound: N-(2-bromophenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D348-0052
N-(2-bromophenyl)-1-(ethanesulfonyl)-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

D348-0052

Molecular Formula

C17H17BrN2O3S (C17 H17 BrN2 O3 S)

Compound Name

N-(2-bromophenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-carboxamide

IUPAC name

N-(2-bromophenyl)-1-(ethanesulfonyl)-23-dihydro-1H-indole-5-carboxamide

SMILES

CCS(N(CC1)c(cc2)c1cc2C(Nc(cccc1)c1Br)=O)(=O)=O

InChI

InChI=1S/C17H17BrN2O3S/c1-2-24(22,23)20-10-9-12-11-13(7-8-16(12)20)17(21)19-15-6-4-3-5-14(15)18/h3-8,11H,2,9-10H2,1H3,(H,19,21)

InChI Key

RDSDHOCECWWQKC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09673616

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.3

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

3.106

Distribution Coefficient, logD

3.102

Water Solubility, LogSw

-3.64

Polar Surface Area

54.316

Acid Dissociation Constant (pKa)

9.50

Base Dissociation Constant (pKb)

-2.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D348-0052 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D348-0052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D348-0052?
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What is the minimum amount of D348-0052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D348-0052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D348-0052
  • 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 D348-0052 available by request