8008-3384 Screening compound: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide

8008-3384 Screening compound: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide
8008-3384 Screening compound: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-3384
N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide

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

8008-3384

Molecular Formula

C17H15N3O2S (C17 H15 N3 O2 S)

Compound Name

N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-methoxybenzamide

IUPAC name

N-(5-benzyl-134-thiadiazol-2-yl)-3-methoxybenzamide

SMILES

COc1cccc(C(Nc2nnc(Cc3ccccc3)s2)=O)c1

InChI

InChI=1S/C17H15N3O2S/c1-22-14-9-5-8-13(11-14)16(21)18-17-20-19-15(23-17)10-12-6-3-2-4-7-12/h2-9,11H,10H2,1H3,(H,18,20,21)

InChI Key

LDJXGWOSJTUEEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01202973

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.799

Distribution Coefficient, logD

3.701

Water Solubility, LogSw

-4.15

Polar Surface Area

54.642

Acid Dissociation Constant (pKa)

8.00

Base Dissociation Constant (pKb)

-3.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.76

8008-3384 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8008-3384 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-3384?
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What is the minimum amount of 8008-3384 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-3384
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-3384
  • 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 8008-3384 available by request