D231-0021 Screening compound: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-N-(prop-2-en-1-yl)benzamide

D231-0021 Screening compound: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-N-(prop-2-en-1-yl)benzamide
D231-0021 Screening compound: N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-N-(prop-2-en-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D231-0021
N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-N-(prop-2-en-1-yl)benzamide

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

D231-0021

Molecular Formula

C21H17N3OS (C21 H17 N3 OS)

Compound Name

N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]-N-(prop-2-en-1-yl)benzamide

IUPAC name

N-[4-(1H-indol-3-yl)-13-thiazol-2-yl]-N-(prop-2-en-1-yl)benzamide

SMILES

C=CCN(C(c1ccccc1)=O)c1nc(-c2c[nH]c3c2cccc3)cs1

InChI

InChI=1S/C21H17N3OS/c1-2-12-24(20(25)15-8-4-3-5-9-15)21-23-19(14-26-21)17-13-22-18-11-7-6-10-16(17)18/h2-11,13-14,22H,1,12H2

InChI Key

IOYFZGRPPPFGDC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04521820

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.167

Distribution Coefficient, logD

5.167

Water Solubility, LogSw

-5.51

Polar Surface Area

35.259

Acid Dissociation Constant (pKa)

18.47

Base Dissociation Constant (pKb)

1.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

D231-0021 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with D231-0021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D231-0021?
Check Price and Availability of D231-0021, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D231-0021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D231-0021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D231-0021
  • 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 D231-0021 available by request