K784-5267 Screening compound: 2-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)-N-[(thiophen-2-yl)methyl]acetamide

K784-5267 Screening compound: 2-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)-N-[(thiophen-2-yl)methyl]acetamide
K784-5267 Screening compound: 2-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)-N-[(thiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K784-5267
2-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)-N-[(thiophen-2-yl)methyl]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

K784-5267

Molecular Formula

C21H26FN3OS2 (C21 H26 FN3 OS2)

Compound Name

2-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)-N-[(thiophen-2-yl)methyl]acetamide

IUPAC name

2-({cyclohexyl[(4-fluorophenyl)methyl]carbamothioyl}amino)-N-[(thiophen-2-yl)methyl]acetamide

SMILES

O=C(CNC(N(Cc(cc1)ccc1F)C1CCCCC1)=S)NCc1cccs1

InChI

InChI=1S/C21H26FN3OS2/c22-17-10-8-16(9-11-17)15-25(18-5-2-1-3-6-18)21(27)24-14-20(26)23-13-19-7-4-12-28-19/h4,7-12,18H,1-3,5-6,13-15H2,(H,23,26)(H,24,27)

InChI Key

GIZXWVANOVYKRL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15098039

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.59

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.860

Distribution Coefficient, logD

4.860

Water Solubility, LogSw

-4.66

Polar Surface Area

36.485

Acid Dissociation Constant (pKa)

14.20

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

K784-5267 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with K784-5267 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K784-5267?
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What is the minimum amount of K784-5267 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K784-5267
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K784-5267
  • 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 K784-5267 available by request