V014-4397 Screening compound: N~3~-(4-methoxybenzyl)-2-[4-(2-methylpentanoyl)piperazino]nicotinamide

V014-4397 Screening compound: N~3~-(4-methoxybenzyl)-2-[4-(2-methylpentanoyl)piperazino]nicotinamide
V014-4397 Screening compound: N~3~-(4-methoxybenzyl)-2-[4-(2-methylpentanoyl)piperazino]nicotinamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-4397
N~3~-(4-methoxybenzyl)-2-[4-(2-methylpentanoyl)piperazino]nicotinamide

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

V014-4397

Molecular Formula

C24H32N4O3 (C24 H32 N4 O3)

Compound Name

N~3~-(4-methoxybenzyl)-2-[4-(2-methylpentanoyl)piperazino]nicotinamide

IUPAC name

N-[(4-methoxyphenyl)methyl]-2-[4-(2-methylpentanoyl)piperazin-1-yl]pyridine-3-carboxamide

SMILES

CCCC(C)C(N(CC1)CCN1c(nccc1)c1C(NCc(cc1)ccc1OC)=O)=O

InChI

InChI=1S/C24H32N4O3/c1-4-6-18(2)24(30)28-15-13-27(14-16-28)22-21(7-5-12-25-22)23(29)26-17-19-8-10-20(31-3)11-9-19/h5,7-12,18H,4,6,13-17H2,1-3H3,(H,26,29)/t18-/m0/s1

InChI Key

VZOIIMHNQJWGCV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD19946230

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

424.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.535

Distribution Coefficient, logD

3.535

Water Solubility, LogSw

-3.60

Polar Surface Area

61.357

Acid Dissociation Constant (pKa)

12.08

Base Dissociation Constant (pKb)

4.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.83

V014-4397 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V014-4397 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-4397?
Check Price and Availability of V014-4397, 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 V014-4397 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-4397
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-4397
  • 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 V014-4397 available by request