8003-5904 Screening compound: (E)-N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)methanimine

8003-5904 Screening compound: (E)-N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)methanimine
8003-5904 Screening compound: (E)-N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-5904
(E)-N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)methanimine

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

8003-5904

Molecular Formula

C18H15ClN2OS (C18 H15 ClN2 OS)

Compound Name

(E)-N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)methanimine

IUPAC name

(E)-N-[4-(4-chlorophenyl)-5-methyl-13-thiazol-2-yl]-1-(4-methoxyphenyl)methanimine

SMILES

Cc1c(-c(cc2)ccc2Cl)nc(/N=C/c(cc2)ccc2OC)s1

InChI

InChI=1S/C18H15ClN2OS/c1-12-17(14-5-7-15(19)8-6-14)21-18(23-12)20-11-13-3-9-16(22-2)10-4-13/h3-11H,1-2H3

InChI Key

YCATZSPYXHCBSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00744519

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.85

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

5.326

Distribution Coefficient, logD

5.326

Water Solubility, LogSw

-6.35

Polar Surface Area

26.455

Acid Dissociation Constant (pKa)

27.56

Base Dissociation Constant (pKb)

2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

8003-5904 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 8003-5904 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-5904?
Check Price and Availability of 8003-5904, 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 8003-5904 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-5904
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-5904
  • 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 8003-5904 available by request