D178-0046 Screening compound: N-[4-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3-thiazol-2-yl]benzamide

D178-0046 Screening compound: N-[4-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3-thiazol-2-yl]benzamide
D178-0046 Screening compound: N-[4-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3-thiazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D178-0046
N-[4-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3-thiazol-2-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

D178-0046

Molecular Formula

C18H14N2O3S (C18 H14 N2 O3 S)

Compound Name

N-[4-(2,3-dihydro-1,4-benzodioxin-2-yl)-1,3-thiazol-2-yl]benzamide

IUPAC name

N-[4-(23-dihydro-14-benzodioxin-2-yl)-13-thiazol-2-yl]benzamide

SMILES

O=C(c1ccccc1)Nc1nc(C2Oc(cccc3)c3OC2)cs1

InChI

InChI=1S/C18H14N2O3S/c21-17(12-6-2-1-3-7-12)20-18-19-13(11-24-18)16-10-22-14-8-4-5-9-15(14)23-16/h1-9,11,16H,10H2,(H,19,20,21)/t16-/m0/s1

InChI Key

DLIPUDWURCNQAZ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD08069356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.147

Distribution Coefficient, logD

3.852

Water Solubility, LogSw

-4.36

Polar Surface Area

48.541

Acid Dissociation Constant (pKa)

7.41

Base Dissociation Constant (pKb)

-1.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

11.10

D178-0046 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with D178-0046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D178-0046?
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What is the minimum amount of D178-0046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D178-0046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D178-0046
  • 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 D178-0046 available by request