V018-9977 Screening compound: 2-(1-cyclopentanecarbonylpiperidin-4-yl)-2-[(4-fluorophenyl)formamido]-N-[(furan-2-yl)methyl]acetamide

V018-9977 Screening compound: 2-(1-cyclopentanecarbonylpiperidin-4-yl)-2-[(4-fluorophenyl)formamido]-N-[(furan-2-yl)methyl]acetamide
V018-9977 Screening compound: 2-(1-cyclopentanecarbonylpiperidin-4-yl)-2-[(4-fluorophenyl)formamido]-N-[(furan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-9977
2-(1-cyclopentanecarbonylpiperidin-4-yl)-2-[(4-fluorophenyl)formamido]-N-[(furan-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

V018-9977

Molecular Formula

C25H30FN3O4 (C25 H30 FN3 O4)

Compound Name

2-(1-cyclopentanecarbonylpiperidin-4-yl)-2-[(4-fluorophenyl)formamido]-N-[(furan-2-yl)methyl]acetamide

IUPAC name

2-(1-cyclopentanecarbonylpiperidin-4-yl)-2-[(4-fluorophenyl)formamido]-N-[(furan-2-yl)methyl]acetamide

SMILES

O=C(C(C(CC1)CCN1C(C1CCCC1)=O)NC(c(cc1)ccc1F)=O)NCc1ccco1

InChI

InChI=1S/C25H30FN3O4/c26-20-9-7-18(8-10-20)23(30)28-22(24(31)27-16-21-6-3-15-33-21)17-11-13-29(14-12-17)25(32)19-4-1-2-5-19/h3,6-10,15,17,19,22H,1-2,4-5,11-14,16H2,(H,27,31)(H,28,30)/t22-/m0/s1

InChI Key

FETORXNKIXEARQ-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD19869635

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.53

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.292

Distribution Coefficient, logD

3.292

Water Solubility, LogSw

-3.43

Polar Surface Area

73.372

Acid Dissociation Constant (pKa)

11.00

Base Dissociation Constant (pKb)

5.27

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

V018-9977 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

SH2 Library (10483 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Endocrine
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V018-9977 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-9977?
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What is the minimum amount of V018-9977 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-9977
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-9977
  • 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 V018-9977 available by request