F090-0717 Screening compound: 7-chloro-1-{3-[(2-chlorobenzyl)oxy]phenyl}-2-(5-methyl-3-isoxazolyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

F090-0717 Screening compound: 7-chloro-1-{3-[(2-chlorobenzyl)oxy]phenyl}-2-(5-methyl-3-isoxazolyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
F090-0717 Screening compound: 7-chloro-1-{3-[(2-chlorobenzyl)oxy]phenyl}-2-(5-methyl-3-isoxazolyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound F090-0717
7-chloro-1-{3-[(2-chlorobenzyl)oxy]phenyl}-2-(5-methyl-3-isoxazolyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

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

F090-0717

Molecular Formula

C28H18Cl2N2O5 (C28 H18 Cl2 N2 O5)

Compound Name

7-chloro-1-{3-[(2-chlorobenzyl)oxy]phenyl}-2-(5-methyl-3-isoxazolyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

IUPAC name

7-chloro-1-{3-[(2-chlorophenyl)methoxy]phenyl}-2-(5-methyl-12-oxazol-3-yl)-1H2H3H9H-chromeno[23-c]pyrrole-39-dione

SMILES

Cc1cc(N(C(C2=C3Oc(ccc(Cl)c4)c4C2=O)c2cccc(OCc(cccc4)c4Cl)c2)C3=O)no1

InChI

InChI=1S/C28H18Cl2N2O5/c1-15-11-23(31-37-15)32-25(16-6-4-7-19(12-16)35-14-17-5-2-3-8-21(17)30)24-26(33)20-13-18(29)9-10-22(20)36-27(24)28(32)34/h2-13,25H,14H2,1H3/t25-/m1/s1

InChI Key

RAFMXLGWNPSOPW-RUZDIDTESA-N

MDL Number (MFCD)

MFCD06772179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.37

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.458

Distribution Coefficient, logD

6.458

Water Solubility, LogSw

-6.09

Polar Surface Area

64.041

Acid Dissociation Constant (pKa)

12.75

Base Dissociation Constant (pKb)

-8.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

10.71

F090-0717 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with F090-0717 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F090-0717?
Check Price and Availability of F090-0717, 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 F090-0717 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F090-0717
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F090-0717
  • 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 F090-0717 available by request