V014-1782 Screening compound: 2-[N-butyl-1-(3-methoxyphenyl)formamido]-N-[(3,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide

V014-1782 Screening compound: 2-[N-butyl-1-(3-methoxyphenyl)formamido]-N-[(3,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide
V014-1782 Screening compound: 2-[N-butyl-1-(3-methoxyphenyl)formamido]-N-[(3,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-1782
2-[N-butyl-1-(3-methoxyphenyl)formamido]-N-[(3,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]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

V014-1782

Molecular Formula

C31H33Cl2N3O3 (C31 H33 Cl2 N3 O3)

Compound Name

2-[N-butyl-1-(3-methoxyphenyl)formamido]-N-[(3,4-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide

IUPAC name

2-[N-butyl-1-(3-methoxyphenyl)formamido]-N-[(34-dichlorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide

SMILES

CCCCN(CC(N(CCc1c[nH]c2c1cccc2)Cc(cc1)cc(Cl)c1Cl)=O)C(c1cc(OC)ccc1)=O

InChI

InChI=1S/C31H33Cl2N3O3/c1-3-4-15-36(31(38)23-8-7-9-25(18-23)39-2)21-30(37)35(20-22-12-13-27(32)28(33)17-22)16-14-24-19-34-29-11-6-5-10-26(24)29/h5-13,17-19,34H,3-4,14-16,20-21H2,1-2H3

InChI Key

KUSAEVYMJQEMKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19734774

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

566.53

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

6.411

Distribution Coefficient, logD

6.411

Water Solubility, LogSw

-6.35

Polar Surface Area

49.504

Acid Dissociation Constant (pKa)

18.49

Base Dissociation Constant (pKb)

-1.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.00

V014-1782 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Indole Derivatives (10091 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Structure:
  • Cyclic compounds
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V014-1782 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-1782?
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What is the minimum amount of V014-1782 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-1782
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-1782
  • 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 V014-1782 available by request