D344-6072 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methylphenyl)sulfanyl]acetamide

D344-6072 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methylphenyl)sulfanyl]acetamide
D344-6072 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methylphenyl)sulfanyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D344-6072
N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methylphenyl)sulfanyl]acetamide

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

D344-6072

Molecular Formula

C22H18N2OS2 (C22 H18 N2 OS2)

Compound Name

N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methylphenyl)sulfanyl]acetamide

IUPAC name

N-[4-(13-benzothiazol-2-yl)phenyl]-2-[(4-methylphenyl)sulfanyl]acetamide

SMILES

Cc(cc1)ccc1SCC(Nc(cc1)ccc1-c1nc(cccc2)c2s1)=O

InChI

InChI=1S/C22H18N2OS2/c1-15-6-12-18(13-7-15)26-14-21(25)23-17-10-8-16(9-11-17)22-24-19-4-2-3-5-20(19)27-22/h2-13H,14H2,1H3,(H,23,25)

InChI Key

LXOZGYJJQRBGLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03780644

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.955

Distribution Coefficient, logD

5.955

Water Solubility, LogSw

-5.60

Polar Surface Area

32.565

Acid Dissociation Constant (pKa)

13.10

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

D344-6072 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D344-6072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D344-6072?
Check Price and Availability of D344-6072, 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 D344-6072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D344-6072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D344-6072
  • 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 D344-6072 available by request