E136-0380 Screening compound: 2-(1H-indol-3-yl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-oxoacetamide

E136-0380 Screening compound: 2-(1H-indol-3-yl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-oxoacetamide
E136-0380 Screening compound: 2-(1H-indol-3-yl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-oxoacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E136-0380
2-(1H-indol-3-yl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-oxoacetamide

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

E136-0380

Molecular Formula

C19H14N4O2S (C19 H14 N4 O2 S)

Compound Name

2-(1H-indol-3-yl)-N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-oxoacetamide

IUPAC name

2-(1H-indol-3-yl)-N-[5-(3-methylphenyl)-134-thiadiazol-2-yl]-2-oxoacetamide

SMILES

Cc1cccc(-c2nnc(NC(C(c3c[nH]c4c3cccc4)=O)=O)s2)c1

InChI

InChI=1S/C19H14N4O2S/c1-11-5-4-6-12(9-11)18-22-23-19(26-18)21-17(25)16(24)14-10-20-15-8-3-2-7-13(14)15/h2-10,20H,1H3,(H,21,23,25)

InChI Key

HFOVMJADEHDIIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14841188

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.464

Distribution Coefficient, logD

4.436

Water Solubility, LogSw

-4.27

Polar Surface Area

70.212

Acid Dissociation Constant (pKa)

8.57

Base Dissociation Constant (pKb)

-3.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

E136-0380 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antiviral Library (67538 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with E136-0380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E136-0380?
Check Price and Availability of E136-0380, 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 E136-0380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E136-0380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E136-0380
  • 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 E136-0380 available by request