E769-1035 Screening compound: 1-(2,5-dimethylphenyl)-3-{[1-ethyl-2-(thiophen-2-yl)-1H-indol-3-yl]methyl}-3-(2-methoxyethyl)urea

E769-1035 Screening compound: 1-(2,5-dimethylphenyl)-3-{[1-ethyl-2-(thiophen-2-yl)-1H-indol-3-yl]methyl}-3-(2-methoxyethyl)urea
E769-1035 Screening compound: 1-(2,5-dimethylphenyl)-3-{[1-ethyl-2-(thiophen-2-yl)-1H-indol-3-yl]methyl}-3-(2-methoxyethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E769-1035
1-(2,5-dimethylphenyl)-3-{[1-ethyl-2-(thiophen-2-yl)-1H-indol-3-yl]methyl}-3-(2-methoxyethyl)urea

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

E769-1035

Molecular Formula

C27H31N3O2S (C27 H31 N3 O2 S)

Compound Name

1-(2,5-dimethylphenyl)-3-{[1-ethyl-2-(thiophen-2-yl)-1H-indol-3-yl]methyl}-3-(2-methoxyethyl)urea

IUPAC name

1-(25-dimethylphenyl)-3-{[1-ethyl-2-(thiophen-2-yl)-1H-indol-3-yl]methyl}-3-(2-methoxyethyl)urea

SMILES

CCn1c(-c2cccs2)c(CN(CCOC)C(Nc2c(C)ccc(C)c2)=O)c2c1cccc2

InChI

InChI=1S/C27H31N3O2S/c1-5-30-24-10-7-6-9-21(24)22(26(30)25-11-8-16-33-25)18-29(14-15-32-4)27(31)28-23-17-19(2)12-13-20(23)3/h6-13,16-17H,5,14-15,18H2,1-4H3,(H,28,31)

InChI Key

KFXKOULUXWVOHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27601479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.63

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.969

Distribution Coefficient, logD

5.969

Water Solubility, LogSw

-5.64

Polar Surface Area

33.866

Acid Dissociation Constant (pKa)

14.21

Base Dissociation Constant (pKb)

-2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

E769-1035 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E769-1035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E769-1035?
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What is the minimum amount of E769-1035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E769-1035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E769-1035
  • 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 E769-1035 available by request