4950-0256 Screening compound: ethyl 4-[2-(piperidin-1-yl)acetamido]benzoate

4950-0256 Screening compound: ethyl 4-[2-(piperidin-1-yl)acetamido]benzoate
4950-0256 Screening compound: ethyl 4-[2-(piperidin-1-yl)acetamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4950-0256
ethyl 4-[2-(piperidin-1-yl)acetamido]benzoate

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

4950-0256

Molecular Formula

C16H22N2O3 (C16 H22 N2 O3)

Compound Name

ethyl 4-[2-(piperidin-1-yl)acetamido]benzoate

IUPAC name

ethyl 4-[2-(piperidin-1-yl)acetamido]benzoate

SMILES

CCOC(c(cc1)ccc1NC(CN1CCCCC1)=O)=O

InChI

InChI=1S/C16H22N2O3/c1-2-21-16(20)13-6-8-14(9-7-13)17-15(19)12-18-10-4-3-5-11-18/h6-9H,2-5,10-12H2,1H3,(H,17,19)

InChI Key

QLGIFPJNYPWBMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01661866

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

290.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.302

Distribution Coefficient, logD

3.257

Water Solubility, LogSw

-3.39

Polar Surface Area

47.874

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

6.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

4950-0256 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

STING Agonist Library (5895 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Others
  • Proteases

References: we are preparing a list of scientific research reports with 4950-0256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4950-0256?
Check Price and Availability of 4950-0256, 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 4950-0256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4950-0256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4950-0256
  • 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 4950-0256 available by request