V018-8652 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylfuran-2-yl)methyl]-2-{N-[2-(piperidin-1-yl)ethyl]4-methylbenzenesulfonamido}acetamide

V018-8652 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylfuran-2-yl)methyl]-2-{N-[2-(piperidin-1-yl)ethyl]4-methylbenzenesulfonamido}acetamide
V018-8652 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylfuran-2-yl)methyl]-2-{N-[2-(piperidin-1-yl)ethyl]4-methylbenzenesulfonamido}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V018-8652
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylfuran-2-yl)methyl]-2-{N-[2-(piperidin-1-yl)ethyl]4-methylbenzenesulfonamido}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

V018-8652

Molecular Formula

C32H43N3O6S (C32 H43 N3 O6 S)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylfuran-2-yl)methyl]-2-{N-[2-(piperidin-1-yl)ethyl]4-methylbenzenesulfonamido}acetamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-N-[(5-methylfuran-2-yl)methyl]-2-{N-[2-(piperidin-1-yl)ethyl]4-methylbenzenesulfonamido}acetamide

SMILES

Cc1ccc(CN(CCc(cc2)cc(OC)c2OC)C(CN(CCN2CCCCC2)S(c2ccc(C)cc2)(=O)=O)=O)o1

InChI

InChI=1S/C32H43N3O6S/c1-25-8-13-29(14-9-25)42(37,38)35(21-20-33-17-6-5-7-18-33)24-32(36)34(23-28-12-10-26(2)41-28)19-16-27-11-15-30(39-3)31(22-27)40-4/h8-15,22H,5-7,16-21,23-24H2,1-4H3

InChI Key

GCGIGGXOPCMRNP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19760653

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

597.78

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.416

Distribution Coefficient, logD

3.877

Water Solubility, LogSw

-4.23

Polar Surface Area

73.489

Acid Dissociation Constant (pKa)

21.87

Base Dissociation Constant (pKb)

7.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.90

V018-8652 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 V018-8652 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V018-8652?
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What is the minimum amount of V018-8652 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V018-8652
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V018-8652
  • 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 V018-8652 available by request