V022-2374 Screening compound: N-benzyl-2-{4-[(2E)-3-phenylprop-2-enamido]piperidin-1-yl}benzamide

V022-2374 Screening compound: N-benzyl-2-{4-[(2E)-3-phenylprop-2-enamido]piperidin-1-yl}benzamide
V022-2374 Screening compound: N-benzyl-2-{4-[(2E)-3-phenylprop-2-enamido]piperidin-1-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V022-2374
N-benzyl-2-{4-[(2E)-3-phenylprop-2-enamido]piperidin-1-yl}benzamide

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

V022-2374

Molecular Formula

C28H29N3O2 (C28 H29 N3 O2)

Compound Name

N-benzyl-2-{4-[(2E)-3-phenylprop-2-enamido]piperidin-1-yl}benzamide

IUPAC name

N-benzyl-2-{4-[(2E)-3-phenylprop-2-enamido]piperidin-1-yl}benzamide

SMILES

O=C(/C=C/c1ccccc1)NC(CC1)CCN1c(cccc1)c1C(NCc1ccccc1)=O

InChI

InChI=1S/C28H29N3O2/c32-27(16-15-22-9-3-1-4-10-22)30-24-17-19-31(20-18-24)26-14-8-7-13-25(26)28(33)29-21-23-11-5-2-6-12-23/h1-16,24H,17-21H2,(H,29,33)(H,30,32)

InChI Key

SCMIRDQYQAZTHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19893543

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

439.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.951

Distribution Coefficient, logD

4.951

Water Solubility, LogSw

-4.86

Polar Surface Area

51.536

Acid Dissociation Constant (pKa)

11.41

Base Dissociation Constant (pKb)

3.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

V022-2374 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with V022-2374 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V022-2374?
Check Price and Availability of V022-2374, 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 V022-2374 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V022-2374
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V022-2374
  • 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 V022-2374 available by request