V012-6671 Screening compound: 3-methyl-N-{[1-(4-methylbenzoyl)piperidin-4-yl](propylcarbamoyl)methyl}butanamide

V012-6671 Screening compound: 3-methyl-N-{[1-(4-methylbenzoyl)piperidin-4-yl](propylcarbamoyl)methyl}butanamide
V012-6671 Screening compound: 3-methyl-N-{[1-(4-methylbenzoyl)piperidin-4-yl](propylcarbamoyl)methyl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-6671
3-methyl-N-{[1-(4-methylbenzoyl)piperidin-4-yl](propylcarbamoyl)methyl}butanamide

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

V012-6671

Molecular Formula

C23H35N3O3 (C23 H35 N3 O3)

Compound Name

3-methyl-N-{[1-(4-methylbenzoyl)piperidin-4-yl](propylcarbamoyl)methyl}butanamide

IUPAC name

3-methyl-N-{[1-(4-methylbenzoyl)piperidin-4-yl](propylcarbamoyl)methyl}butanamide

SMILES

CCCNC(C(C(CC1)CCN1C(c1ccc(C)cc1)=O)NC(CC(C)C)=O)=O

InChI

InChI=1S/C23H35N3O3/c1-5-12-24-22(28)21(25-20(27)15-16(2)3)18-10-13-26(14-11-18)23(29)19-8-6-17(4)7-9-19/h6-9,16,18,21H,5,10-15H2,1-4H3,(H,24,28)(H,25,27)/t21-/m0/s1

InChI Key

LBMIIMFYBFEJMJ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19887890

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.008

Distribution Coefficient, logD

3.008

Water Solubility, LogSw

-3.15

Polar Surface Area

65.237

Acid Dissociation Constant (pKa)

13.06

Base Dissociation Constant (pKb)

1.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

60.90

V012-6671 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with V012-6671 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-6671?
Check Price and Availability of V012-6671, 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 V012-6671 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-6671
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-6671
  • 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 V012-6671 available by request