C361-0073 Screening compound: 1-acetyl-N-(2,2-dimethoxyethyl)-N,2-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide

C361-0073 Screening compound: 1-acetyl-N-(2,2-dimethoxyethyl)-N,2-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide
C361-0073 Screening compound: 1-acetyl-N-(2,2-dimethoxyethyl)-N,2-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C361-0073
1-acetyl-N-(2,2-dimethoxyethyl)-N,2-dimethyl-2,3-dihydro-1H-indole-5-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

C361-0073

Molecular Formula

C16H24N2O5S (C16 H24 N2 O5 S)

Compound Name

1-acetyl-N-(2,2-dimethoxyethyl)-N,2-dimethyl-2,3-dihydro-1H-indole-5-sulfonamide

IUPAC name

1-acetyl-N-(22-dimethoxyethyl)-N2-dimethyl-23-dihydro-1H-indole-5-sulfonamide

SMILES

CC(C1)N(C(C)=O)c(cc2)c1cc2S(N(C)CC(OC)OC)(=O)=O

InChI

InChI=1S/C16H24N2O5S/c1-11-8-13-9-14(6-7-15(13)18(11)12(2)19)24(20,21)17(3)10-16(22-4)23-5/h6-7,9,11,16H,8,10H2,1-5H3/t11-/m1/s1

InChI Key

KTLVMUJAKXGOTR-LLVKDONJSA-N

MDL Number (MFCD)

MFCD05029846

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.44

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.892

Distribution Coefficient, logD

0.892

Water Solubility, LogSw

-2.34

Polar Surface Area

63.926

Acid Dissociation Constant (pKa)

23.37

Base Dissociation Constant (pKb)

-2.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.30

C361-0073 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with C361-0073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C361-0073?
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What is the minimum amount of C361-0073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C361-0073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C361-0073
  • 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 C361-0073 available by request