F782-1513 Screening compound: N-{5-[3-(4-methoxyphenyl)propanamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide

F782-1513 Screening compound: N-{5-[3-(4-methoxyphenyl)propanamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide
F782-1513 Screening compound: N-{5-[3-(4-methoxyphenyl)propanamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F782-1513
N-{5-[3-(4-methoxyphenyl)propanamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide

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

F782-1513

Molecular Formula

C24H27N3O3S (C24 H27 N3 O3 S)

Compound Name

N-{5-[3-(4-methoxyphenyl)propanamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide

IUPAC name

N-{5-[3-(4-methoxyphenyl)propanamido]-13-benzothiazol-2-yl}cyclohexanecarboxamide

SMILES

COc1ccc(CCC(Nc(cc2)cc3c2sc(NC(C2CCCCC2)=O)n3)=O)cc1

InChI

InChI=1S/C24H27N3O3S/c1-30-19-11-7-16(8-12-19)9-14-22(28)25-18-10-13-21-20(15-18)26-24(31-21)27-23(29)17-5-3-2-4-6-17/h7-8,10-13,15,17H,2-6,9,14H2,1H3,(H,25,28)(H,26,27,29)

InChI Key

GHPHYASZYBKWBL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14966531

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.437

Distribution Coefficient, logD

5.436

Water Solubility, LogSw

-5.25

Polar Surface Area

63.705

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

3.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

F782-1513 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Lipid Metabolism Library (9174 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with F782-1513 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F782-1513?
Check Price and Availability of F782-1513, 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 F782-1513 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F782-1513
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F782-1513
  • 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 F782-1513 available by request