E693-0433 Screening compound: 3-({[(5-methylfuran-2-yl)methyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid

E693-0433 Screening compound: 3-({[(5-methylfuran-2-yl)methyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid
E693-0433 Screening compound: 3-({[(5-methylfuran-2-yl)methyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound E693-0433
3-({[(5-methylfuran-2-yl)methyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid

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

E693-0433

Molecular Formula

C24H24N2O3 (C24 H24 N2 O3)

Compound Name

3-({[(5-methylfuran-2-yl)methyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid

IUPAC name

3-({[(5-methylfuran-2-yl)methyl]amino}methyl)-1-[(2-methylphenyl)methyl]-1H-indole-2-carboxylic acid

SMILES

Cc1ccc(CNCc2c(C(O)=O)n(Cc3c(C)cccc3)c3c2cccc3)o1

InChI

InChI=1S/C24H24N2O3/c1-16-7-3-4-8-18(16)15-26-22-10-6-5-9-20(22)21(23(26)24(27)28)14-25-13-19-12-11-17(2)29-19/h3-12,25H,13-15H2,1-2H3,(H,27,28)

InChI Key

SCTFJJVNOXIUAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27601099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.800

Distribution Coefficient, logD

4.800

Water Solubility, LogSw

-4.43

Polar Surface Area

47.905

Acid Dissociation Constant (pKa)

4.47

Base Dissociation Constant (pKb)

11.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

E693-0433 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E693-0433 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E693-0433?
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What is the minimum amount of E693-0433 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E693-0433
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E693-0433
  • 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 E693-0433 available by request