F782-1016 Screening compound: N-(2-acetamido-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

F782-1016 Screening compound: N-(2-acetamido-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
F782-1016 Screening compound: N-(2-acetamido-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F782-1016
N-(2-acetamido-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

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

F782-1016

Molecular Formula

C17H17N5O2S (C17 H17 N5 O2 S)

Compound Name

N-(2-acetamido-1,3-benzothiazol-5-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

IUPAC name

N-(2-acetamido-13-benzothiazol-5-yl)-4567-tetrahydro-1H-indazole-3-carboxamide

SMILES

CC(Nc1nc(cc(cc2)NC(c3n[nH]c4c3CCCC4)=O)c2s1)=O

InChI

InChI=1S/C17H17N5O2S/c1-9(23)18-17-20-13-8-10(6-7-14(13)25-17)19-16(24)15-11-4-2-3-5-12(11)21-22-15/h6-8H,2-5H2,1H3,(H,19,24)(H,21,22)(H,18,20,23)

InChI Key

WCVJWWDEVHCQKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27189743

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.061

Distribution Coefficient, logD

3.058

Water Solubility, LogSw

-3.42

Polar Surface Area

81.306

Acid Dissociation Constant (pKa)

9.64

Base Dissociation Constant (pKb)

3.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

F782-1016 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F782-1016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F782-1016?
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What is the minimum amount of F782-1016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F782-1016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F782-1016
  • 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 F782-1016 available by request