D291-1976 Screening compound: 5-ethoxy-1-methyl-N-(1,3-thiazol-2-yl)-1H-indole-2-carboxamide

D291-1976 Screening compound: 5-ethoxy-1-methyl-N-(1,3-thiazol-2-yl)-1H-indole-2-carboxamide
D291-1976 Screening compound: 5-ethoxy-1-methyl-N-(1,3-thiazol-2-yl)-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D291-1976
5-ethoxy-1-methyl-N-(1,3-thiazol-2-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

D291-1976

Molecular Formula

C15H15N3O2S (C15 H15 N3 O2 S)

Compound Name

5-ethoxy-1-methyl-N-(1,3-thiazol-2-yl)-1H-indole-2-carboxamide

IUPAC name

5-ethoxy-1-methyl-N-(13-thiazol-2-yl)-1H-indole-2-carboxamide

SMILES

CCOc(cc1)cc2c1n(C)c(C(Nc1nccs1)=O)c2

InChI

InChI=1S/C15H15N3O2S/c1-3-20-11-4-5-12-10(8-11)9-13(18(12)2)14(19)17-15-16-6-7-21-15/h4-9H,3H2,1-2H3,(H,16,17,19)

InChI Key

JLDLQQXGMJQTTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26967832

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.219

Distribution Coefficient, logD

3.211

Water Solubility, LogSw

-3.39

Polar Surface Area

42.467

Acid Dissociation Constant (pKa)

9.14

Base Dissociation Constant (pKb)

0.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

D291-1976 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D291-1976 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D291-1976?
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What is the minimum amount of D291-1976 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D291-1976
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D291-1976
  • 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 D291-1976 available by request