2652-0774 Screening compound: 4-fluoro-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide

2652-0774 Screening compound: 4-fluoro-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
2652-0774 Screening compound: 4-fluoro-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2652-0774
4-fluoro-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide

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

2652-0774

Molecular Formula

C14H8FN3O3S (C14 H8 FN3 O3 S)

Compound Name

4-fluoro-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide

IUPAC name

4-fluoro-N-(6-nitro-13-benzothiazol-2-yl)benzamide

SMILES

[O-][N+](c(cc1)cc2c1nc(NC(c(cc1)ccc1F)=O)s2)=O

InChI

InChI=1S/C14H8FN3O3S/c15-9-3-1-8(2-4-9)13(19)17-14-16-11-6-5-10(18(20)21)7-12(11)22-14/h1-7H,(H,16,17,19)

InChI Key

LNBWADNSCHENST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02006437

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.812

Distribution Coefficient, logD

3.791

Water Solubility, LogSw

-4.19

Polar Surface Area

66.472

Acid Dissociation Constant (pKa)

8.71

Base Dissociation Constant (pKb)

-2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2652-0774 in Drug Discovery

Included in Screening Libraries

Proline Kinase Library (2105 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Male
  • Female
  • Endocrine
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 2652-0774 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2652-0774?
Check Price and Availability of 2652-0774, 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 2652-0774 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2652-0774
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2652-0774
  • 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 2652-0774 available by request