R305-0011 Screening compound: 3-{[4-(4-methylpiperidin-1-yl)phenyl]carbamoyl}propanoic acid

R305-0011 Screening compound: 3-{[4-(4-methylpiperidin-1-yl)phenyl]carbamoyl}propanoic acid
R305-0011 Screening compound: 3-{[4-(4-methylpiperidin-1-yl)phenyl]carbamoyl}propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R305-0011
3-{[4-(4-methylpiperidin-1-yl)phenyl]carbamoyl}propanoic acid

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

R305-0011

Molecular Formula

C16H22N2O3 (C16 H22 N2 O3)

Compound Name

3-{[4-(4-methylpiperidin-1-yl)phenyl]carbamoyl}propanoic acid

IUPAC name

3-{[4-(4-methylpiperidin-1-yl)phenyl]carbamoyl}propanoic acid

SMILES

CC(CC1)CCN1c(cc1)ccc1NC(CCC(O)=O)=O

InChI

InChI=1S/C16H22N2O3/c1-12-8-10-18(11-9-12)14-4-2-13(3-5-14)17-15(19)6-7-16(20)21/h2-5,12H,6-11H2,1H3,(H,17,19)(H,20,21)

InChI Key

CAELGZAYBICNOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11891321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.998

Distribution Coefficient, logD

-0.952

Water Solubility, LogSw

-2.54

Polar Surface Area

55.224

Acid Dissociation Constant (pKa)

4.45

Base Dissociation Constant (pKb)

9.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

R305-0011 in Drug Discovery

Included in Screening Libraries

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

Arginase Targeted Library (2009 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Others
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with R305-0011 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R305-0011?
Check Price and Availability of R305-0011, 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 R305-0011 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R305-0011
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R305-0011
  • 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 R305-0011 available by request