Y030-5532 Screening compound: 2-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide

Y030-5532 Screening compound: 2-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
Y030-5532 Screening compound: 2-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-5532
2-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)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

Y030-5532

Molecular Formula

C16H13BrN2OS (C16 H13 BrN2 OS)

Compound Name

2-(4-bromophenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide

IUPAC name

2-(4-bromophenyl)-N-(6-methyl-13-benzothiazol-2-yl)acetamide

SMILES

Cc(cc1)cc2c1nc(NC(Cc(cc1)ccc1Br)=O)s2

InChI

InChI=1S/C16H13BrN2OS/c1-10-2-7-13-14(8-10)21-16(18-13)19-15(20)9-11-3-5-12(17)6-4-11/h2-8H,9H2,1H3,(H,18,19,20)

InChI Key

DMMWYVSKCUJKCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02862460

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.26

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.902

Distribution Coefficient, logD

4.902

Water Solubility, LogSw

-4.65

Polar Surface Area

32.878

Acid Dissociation Constant (pKa)

10.87

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

Y030-5532 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with Y030-5532 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-5532?
Check Price and Availability of Y030-5532, 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 Y030-5532 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-5532
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-5532
  • 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 Y030-5532 available by request