V024-9782 Screening compound: 2-[N-cyclohexyl-1-(4-methoxyphenyl)formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide

V024-9782 Screening compound: 2-[N-cyclohexyl-1-(4-methoxyphenyl)formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide
V024-9782 Screening compound: 2-[N-cyclohexyl-1-(4-methoxyphenyl)formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-9782
2-[N-cyclohexyl-1-(4-methoxyphenyl)formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-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

V024-9782

Molecular Formula

C29H33FN2O3S (C29 H33 FN2 O3 S)

Compound Name

2-[N-cyclohexyl-1-(4-methoxyphenyl)formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide

IUPAC name

2-[N-cyclohexyl-1-(4-methoxyphenyl)formamido]-N-[(4-fluorophenyl)methyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide

SMILES

Cc1ccc(CN(Cc(cc2)ccc2F)C(CN(C2CCCCC2)C(c(cc2)ccc2OC)=O)=O)s1

InChI

InChI=1S/C29H33FN2O3S/c1-21-8-17-27(36-21)19-31(18-22-9-13-24(30)14-10-22)28(33)20-32(25-6-4-3-5-7-25)29(34)23-11-15-26(35-2)16-12-23/h8-17,25H,3-7,18-20H2,1-2H3

InChI Key

HHYQBZXYTCFPRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19977657

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.66

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.951

Distribution Coefficient, logD

5.951

Water Solubility, LogSw

-5.36

Polar Surface Area

39.668

Acid Dissociation Constant (pKa)

21.87

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

V024-9782 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

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

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V024-9782 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-9782?
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What is the minimum amount of V024-9782 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-9782
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-9782
  • 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 V024-9782 available by request