V024-6882 Screening compound: N-(2-{[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-1-benzyl-2-oxoethyl)-3-methylbutanamide

V024-6882 Screening compound: N-(2-{[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-1-benzyl-2-oxoethyl)-3-methylbutanamide
V024-6882 Screening compound: N-(2-{[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-1-benzyl-2-oxoethyl)-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-6882
N-(2-{[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-1-benzyl-2-oxoethyl)-3-methylbutanamide

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

V024-6882

Molecular Formula

C23H24N4O4S (C23 H24 N4 O4 S)

Compound Name

N-(2-{[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]amino}-1-benzyl-2-oxoethyl)-3-methylbutanamide

IUPAC name

N-(1-{[5-(2H-13-benzodioxol-5-yl)-134-thiadiazol-2-yl]carbamoyl}-2-phenylethyl)-3-methylbutanamide

SMILES

CC(C)CC(NC(Cc1ccccc1)C(Nc1nnc(-c(cc2)cc3c2OCO3)s1)=O)=O

InChI

InChI=1S/C23H24N4O4S/c1-14(2)10-20(28)24-17(11-15-6-4-3-5-7-15)21(29)25-23-27-26-22(32-23)16-8-9-18-19(12-16)31-13-30-18/h3-9,12,14,17H,10-11,13H2,1-2H3,(H,24,28)(H,25,27,29)/t17-/m0/s1

InChI Key

IUVMZMXOUVNMHH-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD19723553

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

452.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.731

Distribution Coefficient, logD

4.730

Water Solubility, LogSw

-4.52

Polar Surface Area

87.820

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

-2.70

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.43

V024-6882 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • Epigenetic
Structure:
  • Mimetics
Targets:
  • Others

References: we are preparing a list of scientific research reports with V024-6882 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-6882?
Check Price and Availability of V024-6882, 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 V024-6882 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-6882
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-6882
  • 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 V024-6882 available by request