V031-2862 Screening compound: N-[(4-chlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[N-(3-methoxypropyl)-1-(4-methylphenyl)formamido]acetamide

V031-2862 Screening compound: N-[(4-chlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[N-(3-methoxypropyl)-1-(4-methylphenyl)formamido]acetamide
V031-2862 Screening compound: N-[(4-chlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[N-(3-methoxypropyl)-1-(4-methylphenyl)formamido]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-2862
N-[(4-chlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[N-(3-methoxypropyl)-1-(4-methylphenyl)formamido]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

V031-2862

Molecular Formula

C31H34ClN3O3 (C31 H34 ClN3 O3)

Compound Name

N-[(4-chlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[N-(3-methoxypropyl)-1-(4-methylphenyl)formamido]acetamide

IUPAC name

N-[(4-chlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[N-(3-methoxypropyl)-1-(4-methylphenyl)formamido]acetamide

SMILES

Cc(cc1)ccc1C(N(CCCOC)CC(N(CCc1c[nH]c2c1cccc2)Cc(cc1)ccc1Cl)=O)=O

InChI

InChI=1S/C31H34ClN3O3/c1-23-8-12-25(13-9-23)31(37)35(17-5-19-38-2)22-30(36)34(21-24-10-14-27(32)15-11-24)18-16-26-20-33-29-7-4-3-6-28(26)29/h3-4,6-15,20,33H,5,16-19,21-22H2,1-2H3

InChI Key

GRXWMRFTPWUUKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19779740

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

532.08

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.064

Distribution Coefficient, logD

5.064

Water Solubility, LogSw

-5.20

Polar Surface Area

50.303

Acid Dissociation Constant (pKa)

18.49

Base Dissociation Constant (pKb)

-0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.00

V031-2862 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Indole Derivatives (10091 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Endocrine
Structure:
  • Cyclic compounds
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with V031-2862 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-2862?
Check Price and Availability of V031-2862, 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 V031-2862 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-2862
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-2862
  • 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 V031-2862 available by request