D715-0530 Screening compound: 3-methyl-2-[2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)acetamido]butanoic acid

D715-0530 Screening compound: 3-methyl-2-[2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)acetamido]butanoic acid
D715-0530 Screening compound: 3-methyl-2-[2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)acetamido]butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound D715-0530
3-methyl-2-[2-({4-oxo-1H,2H,3H,4H-cyclopenta[c]chromen-7-yl}oxy)acetamido]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

D715-0530

Molecular Formula

C19H21NO6 (C19 H21 NO6)

Compound Name

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

IUPAC name

(2R)-3-methyl-2-[2-({4-oxo-1H2H3H4H-cyclopenta[c]chromen-7-yl}oxy)acetamido]butanoic acid

SMILES

CC(C)[C@H](C(O)=O)NC(COc(cc1)cc(O2)c1C(CCC1)=C1C2=O)=O

InChI

InChI=1S/C19H21NO6/c1-10(2)17(18(22)23)20-16(21)9-25-11-6-7-13-12-4-3-5-14(12)19(24)26-15(13)8-11/h6-8,10,17H,3-5,9H2,1-2H3,(H,20,21)(H,22,23)/t17-/m1/s1

InChI Key

ZKMYAUUTYOJRFL-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD03469085

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.38

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.672

Distribution Coefficient, logD

-2.915

Water Solubility, LogSw

-2.23

Polar Surface Area

81.178

Acid Dissociation Constant (pKa)

3.81

Base Dissociation Constant (pKb)

-0.86

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.10

D715-0530 in Drug Discovery

Included in Screening Libraries

3D Mimetics PPI Library (1617 compounds)

Protein-Protein Interaction Library (218420 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Structure:
  • Mimetics
  • 3D
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with D715-0530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D715-0530?
Check Price and Availability of D715-0530, 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 D715-0530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D715-0530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D715-0530
  • 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 D715-0530 available by request