8008-5155 Screening compound: 2-{[(E)-1-(4-ethylphenyl)methylidene]amino}-4,5-dimethyl-3-thienyl cyanide

8008-5155 Screening compound: 2-{[(E)-1-(4-ethylphenyl)methylidene]amino}-4,5-dimethyl-3-thienyl cyanide
8008-5155 Screening compound: 2-{[(E)-1-(4-ethylphenyl)methylidene]amino}-4,5-dimethyl-3-thienyl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-5155
2-{[(E)-1-(4-ethylphenyl)methylidene]amino}-4,5-dimethyl-3-thienyl cyanide

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

8008-5155

Molecular Formula

C16H16N2S (C16 H16 N2 S)

Compound Name

2-{[(E)-1-(4-ethylphenyl)methylidene]amino}-4,5-dimethyl-3-thienyl cyanide

IUPAC name

2-[(E)-[(4-ethylphenyl)methylidene]amino]-45-dimethylthiophene-3-carbonitrile

SMILES

CCc1ccc(/C=N/c(sc(C)c2C)c2C#N)cc1

InChI

InChI=1S/C16H16N2S/c1-4-13-5-7-14(8-6-13)10-18-16-15(9-17)11(2)12(3)19-16/h5-8,10H,4H2,1-3H3

InChI Key

BHOIOEYCGSEJIE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01305199

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.38

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.569

Distribution Coefficient, logD

4.569

Water Solubility, LogSw

-4.48

Polar Surface Area

25.216

Acid Dissociation Constant (pKa)

26.44

Base Dissociation Constant (pKb)

3.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8008-5155 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8008-5155 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-5155?
Check Price and Availability of 8008-5155, 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 8008-5155 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-5155
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-5155
  • 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 8008-5155 available by request