8019-6414 Screening compound: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-chloroaniline

8019-6414 Screening compound: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-chloroaniline
8019-6414 Screening compound: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-chloroaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-6414
2-(1,3-benzothiazol-2-ylsulfanyl)-5-chloroaniline

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

8019-6414

Molecular Formula

C13H9ClN2S2 (C13 H9 ClN2 S2)

Compound Name

2-(1,3-benzothiazol-2-ylsulfanyl)-5-chloroaniline

IUPAC name

2-(13-benzothiazol-2-ylsulfanyl)-5-chloroaniline

SMILES

Nc(cc(cc1)Cl)c1Sc1nc(cccc2)c2s1

InChI

InChI=1S/C13H9ClN2S2/c14-8-5-6-11(9(15)7-8)17-13-16-10-3-1-2-4-12(10)18-13/h1-7H,15H2

InChI Key

JPYYBAQUSVDUCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00601637

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.81

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.105

Distribution Coefficient, logD

5.105

Water Solubility, LogSw

-5.55

Polar Surface Area

29.144

Acid Dissociation Constant (pKa)

21.21

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8019-6414 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 8019-6414 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-6414?
Check Price and Availability of 8019-6414, 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 8019-6414 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-6414
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-6414
  • 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 8019-6414 available by request