V028-4957 Screening compound: N-(3-methylbutan-2-yl)-2-[(2-methylphenyl)formamido]-2-(1-propanoylpiperidin-4-yl)acetamide

V028-4957 Screening compound: N-(3-methylbutan-2-yl)-2-[(2-methylphenyl)formamido]-2-(1-propanoylpiperidin-4-yl)acetamide
V028-4957 Screening compound: N-(3-methylbutan-2-yl)-2-[(2-methylphenyl)formamido]-2-(1-propanoylpiperidin-4-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-4957
N-(3-methylbutan-2-yl)-2-[(2-methylphenyl)formamido]-2-(1-propanoylpiperidin-4-yl)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

V028-4957

Molecular Formula

C23H35N3O3 (C23 H35 N3 O3)

Compound Name

N-(3-methylbutan-2-yl)-2-[(2-methylphenyl)formamido]-2-(1-propanoylpiperidin-4-yl)acetamide

IUPAC name

N-(3-methylbutan-2-yl)-2-[(2-methylphenyl)formamido]-2-(1-propanoylpiperidin-4-yl)acetamide

SMILES

CCC(N(CC1)CCC1C(C(NC(C)C(C)C)=O)NC(c1c(C)cccc1)=O)=O

InChI

InChI=1S/C23H35N3O3/c1-6-20(27)26-13-11-18(12-14-26)21(23(29)24-17(5)15(2)3)25-22(28)19-10-8-7-9-16(19)4/h7-10,15,17-18,21H,6,11-14H2,1-5H3,(H,24,29)(H,25,28)

InChI Key

XLUBGBLOOONKFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19874826

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

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.658

Distribution Coefficient, logD

3.658

Water Solubility, LogSw

-3.75

Polar Surface Area

64.244

Acid Dissociation Constant (pKa)

11.40

Base Dissociation Constant (pKb)

1.60

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

60.90

V028-4957 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

Antimitotic Tubulin Library (17355 compounds)

CORONAVIRUS Library (20774 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with V028-4957 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-4957?
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What is the minimum amount of V028-4957 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-4957
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-4957
  • 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 V028-4957 available by request