Y010-0057 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-(4-chloro-2-methylphenoxy)acetamide

Y010-0057 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-(4-chloro-2-methylphenoxy)acetamide
Y010-0057 Screening compound: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-(4-chloro-2-methylphenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y010-0057
N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-(4-chloro-2-methylphenoxy)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

Y010-0057

Molecular Formula

C22H17ClN2O2S (C22 H17 ClN2 O2 S)

Compound Name

N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-(4-chloro-2-methylphenoxy)acetamide

IUPAC name

N-[4-(13-benzothiazol-2-yl)phenyl]-2-(4-chloro-2-methylphenoxy)acetamide

SMILES

Cc(cc(cc1)Cl)c1OCC(Nc(cc1)ccc1-c1nc(cccc2)c2s1)=O

InChI

InChI=1S/C22H17ClN2O2S/c1-14-12-16(23)8-11-19(14)27-13-21(26)24-17-9-6-15(7-10-17)22-25-18-4-2-3-5-20(18)28-22/h2-12H,13H2,1H3,(H,24,26)

InChI Key

LIFWBGKNUWBFRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02639953

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.582

Distribution Coefficient, logD

6.582

Water Solubility, LogSw

-6.22

Polar Surface Area

40.151

Acid Dissociation Constant (pKa)

13.10

Base Dissociation Constant (pKb)

0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

Y010-0057 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y010-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-0057?
Check Price and Availability of Y010-0057, 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 Y010-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-0057
  • 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 Y010-0057 available by request