E728-0602 Screening compound: 4-({[(4,5-dimethylthiophen-3-yl)methyl]sulfanyl}methyl)-5-methyl-2-(4-methylphenyl)-1,3-oxazole

E728-0602 Screening compound: 4-({[(4,5-dimethylthiophen-3-yl)methyl]sulfanyl}methyl)-5-methyl-2-(4-methylphenyl)-1,3-oxazole
E728-0602 Screening compound: 4-({[(4,5-dimethylthiophen-3-yl)methyl]sulfanyl}methyl)-5-methyl-2-(4-methylphenyl)-1,3-oxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound E728-0602
4-({[(4,5-dimethylthiophen-3-yl)methyl]sulfanyl}methyl)-5-methyl-2-(4-methylphenyl)-1,3-oxazole

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

E728-0602

Molecular Formula

C19H21NOS2 (C19 H21 NOS2)

Compound Name

4-({[(4,5-dimethylthiophen-3-yl)methyl]sulfanyl}methyl)-5-methyl-2-(4-methylphenyl)-1,3-oxazole

IUPAC name

4-({[(45-dimethylthiophen-3-yl)methyl]sulfanyl}methyl)-5-methyl-2-(4-methylphenyl)-13-oxazole

SMILES

Cc1c(C)scc1CSCc1c(C)oc(-c2ccc(C)cc2)n1

InChI

InChI=1S/C19H21NOS2/c1-12-5-7-16(8-6-12)19-20-18(14(3)21-19)11-22-9-17-10-23-15(4)13(17)2/h5-8,10H,9,11H2,1-4H3

InChI Key

HRYVTEFXIZCNOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14913248

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.51

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.944

Distribution Coefficient, logD

5.944

Water Solubility, LogSw

-5.68

Polar Surface Area

19.107

Acid Dissociation Constant (pKa)

28.37

Base Dissociation Constant (pKb)

0.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with E728-0602 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E728-0602?
Check Price and Availability of E728-0602, 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 E728-0602 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E728-0602
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E728-0602
  • 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 E728-0602 available by request