0658-0264 Screening compound: 4-(pyren-1-yl)butanoic acid

0658-0264 Screening compound: 4-(pyren-1-yl)butanoic acid
0658-0264 Screening compound: 4-(pyren-1-yl)butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0658-0264
4-(pyren-1-yl)butanoic 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

0658-0264

Molecular Formula

C20H16O2 (C20 H16 O2)

Compound Name

4-(pyren-1-yl)butanoic acid

IUPAC name

4-(pyren-1-yl)butanoic acid

SMILES

OC(CCCc1ccc(ccc2ccc3)c4c2c3ccc14)=O

InChI

InChI=1S/C20H16O2/c21-18(22)6-2-3-13-7-8-16-10-9-14-4-1-5-15-11-12-17(13)20(16)19(14)15/h1,4-5,7-12H,2-3,6H2,(H,21,22)

InChI Key

QXYRRCOJHNZVDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00004141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.054

Distribution Coefficient, logD

2.498

Water Solubility, LogSw

-6.05

Polar Surface Area

27.808

Acid Dissociation Constant (pKa)

4.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

0658-0264 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0658-0264 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0658-0264?
Check Price and Availability of 0658-0264, 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 0658-0264 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0658-0264
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0658-0264
  • 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 0658-0264 available by request