3532-1025 Screening compound: 2-({2-chloro-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)propanoic acid

3532-1025 Screening compound: 2-({2-chloro-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)propanoic acid
3532-1025 Screening compound: 2-({2-chloro-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 3532-1025
2-({2-chloro-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)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

3532-1025

Molecular Formula

C16H15ClO5 (C16 H15 ClO5)

Compound Name

2-({2-chloro-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl}oxy)propanoic acid

IUPAC name

2-({2-chloro-6-oxo-6H7H8H9H10H-cyclohexa[c]chromen-3-yl}oxy)propanoic acid

SMILES

CC(C(O)=O)Oc(cc(c(C1=C2CCCC1)c1)OC2=O)c1Cl

InChI

InChI=1S/C16H15ClO5/c1-8(15(18)19)21-14-7-13-11(6-12(14)17)9-4-2-3-5-10(9)16(20)22-13/h6-8H,2-5H2,1H3,(H,18,19)/t8-/m0/s1

InChI Key

UDRXBMZEWXEFGZ-QMMMGPOBSA-N

MDL Number (MFCD)

MFCD01832461

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.74

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.022

Distribution Coefficient, logD

0.023

Water Solubility, LogSw

-4.06

Polar Surface Area

56.365

Acid Dissociation Constant (pKa)

3.40

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

3532-1025 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 3532-1025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3532-1025?
Check Price and Availability of 3532-1025, 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 3532-1025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3532-1025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3532-1025
  • 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 3532-1025 available by request