8015-7730 Screening compound: pentadecyl 4,5-dichloro-3-isothiazolecarboxylate

8015-7730 Screening compound: pentadecyl 4,5-dichloro-3-isothiazolecarboxylate
8015-7730 Screening compound: pentadecyl 4,5-dichloro-3-isothiazolecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-7730
pentadecyl 4,5-dichloro-3-isothiazolecarboxylate

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

8015-7730

Molecular Formula

C19H31Cl2NO2S (C19 H31 Cl2 NO2 S)

Compound Name

pentadecyl 4,5-dichloro-3-isothiazolecarboxylate

IUPAC name

pentadecyl 45-dichloro-12-thiazole-3-carboxylate

SMILES

CCCCCCCCCCCCCCCOC(c1nsc(Cl)c1Cl)=O

InChI

InChI=1S/C19H31Cl2NO2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-24-19(23)17-16(20)18(21)25-22-17/h2-15H2,1H3

InChI Key

HTKLTEPXKKXRME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05258248

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

9.225

Distribution Coefficient, logD

9.225

Water Solubility, LogSw

-6.78

Polar Surface Area

32.548

Acid Dissociation Constant (pKa)

28.25

Base Dissociation Constant (pKb)

-8.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

78.95

References: we are preparing a list of scientific research reports with 8015-7730 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-7730?
Check Price and Availability of 8015-7730, 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 8015-7730 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-7730
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-7730
  • 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 8015-7730 available by request