D231-0015 Screening compound: N-benzyl-N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]acetamide

D231-0015 Screening compound: N-benzyl-N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]acetamide
D231-0015 Screening compound: N-benzyl-N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D231-0015
N-benzyl-N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]acetamide

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

D231-0015

Molecular Formula

C20H17N3OS (C20 H17 N3 OS)

Compound Name

N-benzyl-N-[4-(1H-indol-3-yl)-1,3-thiazol-2-yl]acetamide

IUPAC name

N-benzyl-N-[4-(1H-indol-3-yl)-13-thiazol-2-yl]acetamide

SMILES

CC(N(Cc1ccccc1)c1nc(-c2c[nH]c3c2cccc3)cs1)=O

InChI

InChI=1S/C20H17N3OS/c1-14(24)23(12-15-7-3-2-4-8-15)20-22-19(13-25-20)17-11-21-18-10-6-5-9-16(17)18/h2-11,13,21H,12H2,1H3

InChI Key

DGVNZYPJRUMROG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04515167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.44

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.857

Distribution Coefficient, logD

4.857

Water Solubility, LogSw

-4.73

Polar Surface Area

35.749

Acid Dissociation Constant (pKa)

18.47

Base Dissociation Constant (pKb)

1.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

D231-0015 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D231-0015 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D231-0015?
Check Price and Availability of D231-0015, 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 D231-0015 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D231-0015
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D231-0015
  • 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 D231-0015 available by request