7954-4278 Screening compound: 5-(adamantane-1-carbonyl)-N2-(4-fluorophenyl)-1,3-thiazole-2,4-diamine

7954-4278 Screening compound: 5-(adamantane-1-carbonyl)-N2-(4-fluorophenyl)-1,3-thiazole-2,4-diamine
7954-4278 Screening compound: 5-(adamantane-1-carbonyl)-N2-(4-fluorophenyl)-1,3-thiazole-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7954-4278
5-(adamantane-1-carbonyl)-N2-(4-fluorophenyl)-1,3-thiazole-2,4-diamine

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

7954-4278

Molecular Formula

C20H22FN3OS (C20 H22 FN3 OS)

Compound Name

5-(adamantane-1-carbonyl)-N2-(4-fluorophenyl)-1,3-thiazole-2,4-diamine

IUPAC name

5-(adamantane-1-carbonyl)-N2-(4-fluorophenyl)-13-thiazole-24-diamine

SMILES

Nc1c(C(C2(CC(C3)C4)CC4CC3C2)=O)sc(Nc(cc2)ccc2F)n1

InChI

InChI=1S/C20H22FN3OS/c21-14-1-3-15(4-2-14)23-19-24-18(22)16(26-19)17(25)20-8-11-5-12(9-20)7-13(6-11)10-20/h1-4,11-13H,5-10,22H2,(H,23,24)

InChI Key

UBFJWIPTSYLOPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05259068

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.835

Distribution Coefficient, logD

5.835

Water Solubility, LogSw

-5.85

Polar Surface Area

53.394

Acid Dissociation Constant (pKa)

16.65

Base Dissociation Constant (pKb)

3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

7954-4278 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Ion Channels Focused Library (26372 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Nervous system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels
  • Phosphatases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7954-4278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7954-4278?
Check Price and Availability of 7954-4278, 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 7954-4278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7954-4278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7954-4278
  • 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 7954-4278 available by request