D491-6420 Screening compound: 2-methoxy-N-[3-(5-methylthiophen-2-yl)-1,2,4-thiadiazol-5-yl]benzamide

D491-6420 Screening compound: 2-methoxy-N-[3-(5-methylthiophen-2-yl)-1,2,4-thiadiazol-5-yl]benzamide
D491-6420 Screening compound: 2-methoxy-N-[3-(5-methylthiophen-2-yl)-1,2,4-thiadiazol-5-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D491-6420
2-methoxy-N-[3-(5-methylthiophen-2-yl)-1,2,4-thiadiazol-5-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

D491-6420

Molecular Formula

C15H13N3O2S2 (C15 H13 N3 O2 S2)

Compound Name

2-methoxy-N-[3-(5-methylthiophen-2-yl)-1,2,4-thiadiazol-5-yl]benzamide

IUPAC name

2-methoxy-N-[3-(5-methylthiophen-2-yl)-124-thiadiazol-5-yl]benzamide

SMILES

Cc1ccc(-c2nsc(NC(c(cccc3)c3OC)=O)n2)s1

InChI

InChI=1S/C15H13N3O2S2/c1-9-7-8-12(21-9)13-16-15(22-18-13)17-14(19)10-5-3-4-6-11(10)20-2/h3-8H,1-2H3,(H,16,17,18,19)

InChI Key

GXAXMKOWZVUSPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14832500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.209

Distribution Coefficient, logD

4.070

Water Solubility, LogSw

-4.48

Polar Surface Area

52.566

Acid Dissociation Constant (pKa)

7.82

Base Dissociation Constant (pKb)

-2.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

D491-6420 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D491-6420 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D491-6420?
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What is the minimum amount of D491-6420 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D491-6420
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D491-6420
  • 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 D491-6420 available by request