8008-4517 Screening compound: 3,4-dichloro-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide

8008-4517 Screening compound: 3,4-dichloro-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide
8008-4517 Screening compound: 3,4-dichloro-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-4517
3,4-dichloro-N-(5-phenyl-1,3,4-thiadiazol-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

8008-4517

Molecular Formula

C15H9Cl2N3OS (C15 H9 Cl2 N3 OS)

Compound Name

3,4-dichloro-N-(5-phenyl-1,3,4-thiadiazol-2-yl)benzamide

IUPAC name

34-dichloro-N-(5-phenyl-134-thiadiazol-2-yl)benzamide

SMILES

O=C(c(cc1)cc(Cl)c1Cl)Nc1nnc(-c2ccccc2)s1

InChI

InChI=1S/C15H9Cl2N3OS/c16-11-7-6-10(8-12(11)17)13(21)18-15-20-19-14(22-15)9-4-2-1-3-5-9/h1-8H,(H,18,20,21)

InChI Key

XTXXDJAUFPEDDC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01131464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.010

Distribution Coefficient, logD

4.744

Water Solubility, LogSw

-5.43

Polar Surface Area

46.603

Acid Dissociation Constant (pKa)

7.47

Base Dissociation Constant (pKb)

-3.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8008-4517 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Angiogenesis library (14822 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 8008-4517 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-4517?
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What is the minimum amount of 8008-4517 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-4517
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-4517
  • 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 8008-4517 available by request