D308-0496 Screening compound: 2,4-dimethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,3-thiazole-5-carboxamide

D308-0496 Screening compound: 2,4-dimethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,3-thiazole-5-carboxamide
D308-0496 Screening compound: 2,4-dimethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D308-0496
2,4-dimethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,3-thiazole-5-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

D308-0496

Molecular Formula

C13H15N3OS2 (C13 H15 N3 OS2)

Compound Name

2,4-dimethyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,3-thiazole-5-carboxamide

IUPAC name

24-dimethyl-N-(4567-tetrahydro-13-benzothiazol-2-yl)-13-thiazole-5-carboxamide

SMILES

Cc1c(C(Nc2nc(CCCC3)c3s2)=O)sc(C)n1

InChI

InChI=1S/C13H15N3OS2/c1-7-11(18-8(2)14-7)12(17)16-13-15-9-5-3-4-6-10(9)19-13/h3-6H2,1-2H3,(H,15,16,17)

InChI Key

GXDFHYHESDWXMX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09540714

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.41

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

3.501

Distribution Coefficient, logD

2.548

Water Solubility, LogSw

-3.72

Polar Surface Area

45.186

Acid Dissociation Constant (pKa)

6.50

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

D308-0496 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

CNS MPO Library (28609 compounds)

CNS Targets (44014 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with D308-0496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D308-0496?
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What is the minimum amount of D308-0496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D308-0496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D308-0496
  • 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 D308-0496 available by request