D319-0382 Screening compound: 4-methyl-N-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,2,3-thiadiazole-5-carboxamide

D319-0382 Screening compound: 4-methyl-N-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,2,3-thiadiazole-5-carboxamide
D319-0382 Screening compound: 4-methyl-N-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,2,3-thiadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D319-0382
4-methyl-N-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,2,3-thiadiazole-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

D319-0382

Molecular Formula

C14H13N5OS3 (C14 H13 N5 OS3)

Compound Name

4-methyl-N-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-1,2,3-thiadiazole-5-carboxamide

IUPAC name

4-methyl-N-(5-{[(4-methylphenyl)methyl]sulfanyl}-134-thiadiazol-2-yl)-123-thiadiazole-5-carboxamide

SMILES

Cc1c(C(Nc2nnc(SCc3ccc(C)cc3)s2)=O)snn1

InChI

InChI=1S/C14H13N5OS3/c1-8-3-5-10(6-4-8)7-21-14-18-17-13(22-14)15-12(20)11-9(2)16-19-23-11/h3-6H,7H2,1-2H3,(H,15,17,20)

InChI Key

FTLQRYGDUZQHPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08549534

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.514

Distribution Coefficient, logD

3.206

Water Solubility, LogSw

-3.68

Polar Surface Area

68.407

Acid Dissociation Constant (pKa)

7.39

Base Dissociation Constant (pKb)

-2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

D319-0382 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D319-0382 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D319-0382?
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What is the minimum amount of D319-0382 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D319-0382
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D319-0382
  • 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 D319-0382 available by request