3992-0364 Screening compound: 3-(2-chlorophenyl)-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-methyl-1,2-oxazole-4-carboxamide

3992-0364 Screening compound: 3-(2-chlorophenyl)-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-methyl-1,2-oxazole-4-carboxamide
3992-0364 Screening compound: 3-(2-chlorophenyl)-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-methyl-1,2-oxazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3992-0364
3-(2-chlorophenyl)-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-methyl-1,2-oxazole-4-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

3992-0364

Molecular Formula

C20H14Cl2N4O2S (C20 H14 Cl2 N4 O2 S)

Compound Name

3-(2-chlorophenyl)-N-{5-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl}-5-methyl-1,2-oxazole-4-carboxamide

IUPAC name

3-(2-chlorophenyl)-N-{5-[(4-chlorophenyl)methyl]-134-thiadiazol-2-yl}-5-methyl-12-oxazole-4-carboxamide

SMILES

Cc1c(C(Nc2nnc(Cc(cc3)ccc3Cl)s2)=O)c(-c(cccc2)c2Cl)no1

InChI

InChI=1S/C20H14Cl2N4O2S/c1-11-17(18(26-28-11)14-4-2-3-5-15(14)22)19(27)23-20-25-24-16(29-20)10-12-6-8-13(21)9-7-12/h2-9H,10H2,1H3,(H,23,25,27)

InChI Key

GSNYPQINNIPFKR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02333216

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.163

Distribution Coefficient, logD

4.776

Water Solubility, LogSw

-5.51

Polar Surface Area

69.058

Acid Dissociation Constant (pKa)

7.24

Base Dissociation Constant (pKb)

-2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

3992-0364 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

GABA Library (7115 compounds)

GPCR Targeted Library (31838 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Eye
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Agro:
  • Agro
Targets:
  • GPCR
  • Ion Channels
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 3992-0364 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3992-0364?
Check Price and Availability of 3992-0364, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3992-0364 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3992-0364
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3992-0364
  • 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 3992-0364 available by request