G732-3113 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-5-(dimethylsulfamoyl)-1-(prop-2-en-1-yl)-1H-indole-2-carboxamide

G732-3113 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-5-(dimethylsulfamoyl)-1-(prop-2-en-1-yl)-1H-indole-2-carboxamide
G732-3113 Screening compound: N-{[4-(dimethylamino)phenyl]methyl}-5-(dimethylsulfamoyl)-1-(prop-2-en-1-yl)-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G732-3113
N-{[4-(dimethylamino)phenyl]methyl}-5-(dimethylsulfamoyl)-1-(prop-2-en-1-yl)-1H-indole-2-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

G732-3113

Molecular Formula

C23H28N4O3S (C23 H28 N4 O3 S)

Compound Name

N-{[4-(dimethylamino)phenyl]methyl}-5-(dimethylsulfamoyl)-1-(prop-2-en-1-yl)-1H-indole-2-carboxamide

IUPAC name

N-{[4-(dimethylamino)phenyl]methyl}-5-(dimethylsulfamoyl)-1-(prop-2-en-1-yl)-1H-indole-2-carboxamide

SMILES

CN(C)c1ccc(CNC(c2cc(cc(cc3)S(N(C)C)(=O)=O)c3n2CC=C)=O)cc1

InChI

InChI=1S/C23H28N4O3S/c1-6-13-27-21-12-11-20(31(29,30)26(4)5)14-18(21)15-22(27)23(28)24-16-17-7-9-19(10-8-17)25(2)3/h6-12,14-15H,1,13,16H2,2-5H3,(H,24,28)

InChI Key

QCFOKCFZGYYZNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27155013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.460

Distribution Coefficient, logD

3.445

Water Solubility, LogSw

-3.81

Polar Surface Area

61.824

Acid Dissociation Constant (pKa)

12.96

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

G732-3113 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 G732-3113 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G732-3113?
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What is the minimum amount of G732-3113 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G732-3113
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G732-3113
  • 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 G732-3113 available by request