D715-0219 Screening compound: 2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)-2-phenylacetic acid

D715-0219 Screening compound: 2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)-2-phenylacetic acid
D715-0219 Screening compound: 2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)-2-phenylacetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D715-0219
2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)-2-phenylacetic 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

D715-0219

Molecular Formula

C20H16O5 (C20 H16 O5)

Compound Name

2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)-2-phenylacetic acid

IUPAC name

2-({4-oxo-1H2H3H4H-cyclopenta[c]chromen-7-yl}oxy)-2-phenylacetic acid

SMILES

OC(C(c1ccccc1)Oc(cc1)cc(O2)c1C(CCC1)=C1C2=O)=O

InChI

InChI=1S/C20H16O5/c21-19(22)18(12-5-2-1-3-6-12)24-13-9-10-15-14-7-4-8-16(14)20(23)25-17(15)11-13/h1-3,5-6,9-11,18H,4,7-8H2,(H,21,22)/t18-/m1/s1

InChI Key

VTULPAQMHCOZTG-GOSISDBHSA-N

MDL Number (MFCD)

MFCD02222084

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.34

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.797

Distribution Coefficient, logD

-1.429

Water Solubility, LogSw

-3.33

Polar Surface Area

56.359

Acid Dissociation Constant (pKa)

3.17

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

D715-0219 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Human Transcription Factors Annotated Library (5098 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D715-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D715-0219?
Check Price and Availability of D715-0219, 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 D715-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D715-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D715-0219
  • 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 D715-0219 available by request