D328-0327 Screening compound: 5-chloro-3-methyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-benzofuran-2-carboxamide

D328-0327 Screening compound: 5-chloro-3-methyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-benzofuran-2-carboxamide
D328-0327 Screening compound: 5-chloro-3-methyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D328-0327
5-chloro-3-methyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-benzofuran-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

D328-0327

Molecular Formula

C17H15ClN2O2S (C17 H15 ClN2 O2 S)

Compound Name

5-chloro-3-methyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-benzofuran-2-carboxamide

IUPAC name

5-chloro-3-methyl-N-(4567-tetrahydro-13-benzothiazol-2-yl)-1-benzofuran-2-carboxamide

SMILES

Cc1c(C(Nc2nc(CCCC3)c3s2)=O)oc(cc2)c1cc2Cl

InChI

InChI=1S/C17H15ClN2O2S/c1-9-11-8-10(18)6-7-13(11)22-15(9)16(21)20-17-19-12-4-2-3-5-14(12)23-17/h6-8H,2-5H2,1H3,(H,19,20,21)

InChI Key

PPAQCQWNQBYESA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06945626

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.578

Distribution Coefficient, logD

4.482

Water Solubility, LogSw

-5.82

Polar Surface Area

43.323

Acid Dissociation Constant (pKa)

6.34

Base Dissociation Constant (pKb)

4.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

D328-0327 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

CNS Targets (44014 compounds)

GABA Library (7115 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
  • Eye
Targets:
  • Kinases
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D328-0327 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D328-0327?
Check Price and Availability of D328-0327, 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 D328-0327 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D328-0327
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D328-0327
  • 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 D328-0327 available by request