4386-3890 Screening compound: (2Z)-4-(5-chlorothiophen-2-yl)-N-(4-ethoxyphenyl)-3-methyl-2,3-dihydro-1,3-thiazol-2-imine

4386-3890 Screening compound: (2Z)-4-(5-chlorothiophen-2-yl)-N-(4-ethoxyphenyl)-3-methyl-2,3-dihydro-1,3-thiazol-2-imine
4386-3890 Screening compound: (2Z)-4-(5-chlorothiophen-2-yl)-N-(4-ethoxyphenyl)-3-methyl-2,3-dihydro-1,3-thiazol-2-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4386-3890
(2Z)-4-(5-chlorothiophen-2-yl)-N-(4-ethoxyphenyl)-3-methyl-2,3-dihydro-1,3-thiazol-2-imine

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

4386-3890

Molecular Formula

C16H15ClN2OS2 (C16 H15 ClN2 OS2)

Compound Name

(2Z)-4-(5-chlorothiophen-2-yl)-N-(4-ethoxyphenyl)-3-methyl-2,3-dihydro-1,3-thiazol-2-imine

IUPAC name

(2Z)-4-(5-chlorothiophen-2-yl)-N-(4-ethoxyphenyl)-3-methyl-23-dihydro-13-thiazol-2-imine

SMILES

CCOc(cc1)ccc1/N=C1\SC=C(c(s2)ccc2Cl)N1C

InChI

InChI=1S/C16H15ClN2OS2/c1-3-20-12-6-4-11(5-7-12)18-16-19(2)13(10-21-16)14-8-9-15(17)22-14/h4-10H,3H2,1-2H3

InChI Key

DYUKDBWHLHFPKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03069155

Chemical and Physical Properties

Saltdata

HBr

Molecular Weight

350.89

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.210

Distribution Coefficient, logD

5.210

Water Solubility, LogSw

-5.64

Polar Surface Area

19.482

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

4.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

4386-3890 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4386-3890 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4386-3890?
Check Price and Availability of 4386-3890, 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 4386-3890 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4386-3890
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4386-3890
  • 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 4386-3890 available by request