E699-1462 Screening compound: 1-cyclobutanecarbonyl-N-(2,5-diethoxyphenyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonamide

E699-1462 Screening compound: 1-cyclobutanecarbonyl-N-(2,5-diethoxyphenyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonamide
E699-1462 Screening compound: 1-cyclobutanecarbonyl-N-(2,5-diethoxyphenyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E699-1462
1-cyclobutanecarbonyl-N-(2,5-diethoxyphenyl)-2-methyl-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

E699-1462

Molecular Formula

C24H30N2O5S (C24 H30 N2 O5 S)

Compound Name

1-cyclobutanecarbonyl-N-(2,5-diethoxyphenyl)-2-methyl-2,3-dihydro-1H-indole-5-sulfonamide

IUPAC name

1-cyclobutanecarbonyl-N-(25-diethoxyphenyl)-2-methyl-23-dihydro-1H-indole-5-sulfonamide

SMILES

CCOc(cc1)cc(NS(c(cc2)cc(CC3C)c2N3C(C2CCC2)=O)(=O)=O)c1OCC

InChI

InChI=1S/C24H30N2O5S/c1-4-30-19-9-12-23(31-5-2)21(15-19)25-32(28,29)20-10-11-22-18(14-20)13-16(3)26(22)24(27)17-7-6-8-17/h9-12,14-17,25H,4-8,13H2,1-3H3/t16-/m1/s1

InChI Key

FUEPSRQAWUHBOB-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD14910811

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.58

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.896

Distribution Coefficient, logD

3.528

Water Solubility, LogSw

-4.00

Polar Surface Area

69.665

Acid Dissociation Constant (pKa)

7.28

Base Dissociation Constant (pKb)

-2.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

E699-1462 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E699-1462 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E699-1462?
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What is the minimum amount of E699-1462 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E699-1462
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E699-1462
  • 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 E699-1462 available by request