V028-7506 Screening compound: 4-(4-{2-[1-(4-chlorophenyl)-N-(prop-2-en-1-yl)formamido]acetamido}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide

V028-7506 Screening compound: 4-(4-{2-[1-(4-chlorophenyl)-N-(prop-2-en-1-yl)formamido]acetamido}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide
V028-7506 Screening compound: 4-(4-{2-[1-(4-chlorophenyl)-N-(prop-2-en-1-yl)formamido]acetamido}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-7506
4-(4-{2-[1-(4-chlorophenyl)-N-(prop-2-en-1-yl)formamido]acetamido}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide

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

V028-7506

Molecular Formula

C26H32ClN5O3 (C26 H32 ClN5 O3)

Compound Name

4-(4-{2-[1-(4-chlorophenyl)-N-(prop-2-en-1-yl)formamido]acetamido}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide

IUPAC name

4-(4-{2-[1-(4-chlorophenyl)-N-(prop-2-en-1-yl)formamido]acetamido}phenyl)-N-(propan-2-yl)piperazine-1-carboxamide

SMILES

CC(C)NC(N(CC1)CCN1c(cc1)ccc1NC(CN(CC=C)C(c(cc1)ccc1Cl)=O)=O)=O

InChI

InChI=1S/C26H32ClN5O3/c1-4-13-32(25(34)20-5-7-21(27)8-6-20)18-24(33)29-22-9-11-23(12-10-22)30-14-16-31(17-15-30)26(35)28-19(2)3/h4-12,19H,1,13-18H2,2-3H3,(H,28,35)(H,29,33)

InChI Key

CUKJGGPQOHEJJQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14255722

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

498.02

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.817

Distribution Coefficient, logD

3.795

Water Solubility, LogSw

-4.40

Polar Surface Area

68.875

Acid Dissociation Constant (pKa)

12.60

Base Dissociation Constant (pKb)

6.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

V028-7506 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V028-7506 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-7506?
Check Price and Availability of V028-7506, 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 V028-7506 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-7506
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-7506
  • 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 V028-7506 available by request