E938-0026 Screening compound: 1,3-dimethyl 5-[(1,3-dioxo-2-phenyl-2,3-dihydro-1H-inden-2-yl)amino]benzene-1,3-dicarboxylate

E938-0026 Screening compound: 1,3-dimethyl 5-[(1,3-dioxo-2-phenyl-2,3-dihydro-1H-inden-2-yl)amino]benzene-1,3-dicarboxylate
E938-0026 Screening compound: 1,3-dimethyl 5-[(1,3-dioxo-2-phenyl-2,3-dihydro-1H-inden-2-yl)amino]benzene-1,3-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E938-0026
1,3-dimethyl 5-[(1,3-dioxo-2-phenyl-2,3-dihydro-1H-inden-2-yl)amino]benzene-1,3-dicarboxylate

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

E938-0026

Molecular Formula

C25H19NO6 (C25 H19 NO6)

Compound Name

1,3-dimethyl 5-[(1,3-dioxo-2-phenyl-2,3-dihydro-1H-inden-2-yl)amino]benzene-1,3-dicarboxylate

IUPAC name

13-dimethyl 5-[(13-dioxo-2-phenyl-23-dihydro-1H-inden-2-yl)amino]benzene-13-dicarboxylate

SMILES

COC(c1cc(NC(C(c2c3cccc2)=O)(C3=O)c2ccccc2)cc(C(OC)=O)c1)=O

InChI

InChI=1S/C25H19NO6/c1-31-23(29)15-12-16(24(30)32-2)14-18(13-15)26-25(17-8-4-3-5-9-17)21(27)19-10-6-7-11-20(19)22(25)28/h3-14,26H,1-2H3

InChI Key

JFBJZHHHQVEDQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09696415

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.43

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.066

Distribution Coefficient, logD

5.066

Water Solubility, LogSw

-4.86

Polar Surface Area

79.480

Acid Dissociation Constant (pKa)

15.39

Base Dissociation Constant (pKb)

-10.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

E938-0026 in Drug Discovery

Included in Screening Libraries

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Nervous system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E938-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E938-0026?
Check Price and Availability of E938-0026, 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 E938-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E938-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E938-0026
  • 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 E938-0026 available by request