6699-0093 Screening compound: 1-(3-ethoxy-4-propoxyphenyl)-2-(5-methylpyridin-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

6699-0093 Screening compound: 1-(3-ethoxy-4-propoxyphenyl)-2-(5-methylpyridin-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
6699-0093 Screening compound: 1-(3-ethoxy-4-propoxyphenyl)-2-(5-methylpyridin-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 6699-0093
1-(3-ethoxy-4-propoxyphenyl)-2-(5-methylpyridin-2-yl)-1H,2H,3H,9H-chromeno[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

6699-0093

Molecular Formula

C28H26N2O5 (C28 H26 N2 O5)

Compound Name

1-(3-ethoxy-4-propoxyphenyl)-2-(5-methylpyridin-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

IUPAC name

1-(3-ethoxy-4-propoxyphenyl)-2-(5-methylpyridin-2-yl)-1H2H3H9H-chromeno[23-c]pyrrole-39-dione

SMILES

CCCOc(ccc(C(C1=C(C2=O)Oc(cccc3)c3C1=O)N2c1ncc(C)cc1)c1)c1OCC

InChI

InChI=1S/C28H26N2O5/c1-4-14-34-21-12-11-18(15-22(21)33-5-2)25-24-26(31)19-8-6-7-9-20(19)35-27(24)28(32)30(25)23-13-10-17(3)16-29-23/h6-13,15-16,25H,4-5,14H2,1-3H3/t25-/m1/s1

InChI Key

IAHGMSHNIATLIN-RUZDIDTESA-N

MDL Number (MFCD)

MFCD04448274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.123

Distribution Coefficient, logD

5.123

Water Solubility, LogSw

-4.84

Polar Surface Area

59.437

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

-1.64

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

6699-0093 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 6699-0093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6699-0093?
Check Price and Availability of 6699-0093, 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 6699-0093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6699-0093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6699-0093
  • 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 6699-0093 available by request