E146-1297 Screening compound: 2-(diethylamino)ethyl 4-{1-methyl-1H,4H-chromeno[4,3-c]pyrazole-3-amido}benzoate

E146-1297 Screening compound: 2-(diethylamino)ethyl 4-{1-methyl-1H,4H-chromeno[4,3-c]pyrazole-3-amido}benzoate
E146-1297 Screening compound: 2-(diethylamino)ethyl 4-{1-methyl-1H,4H-chromeno[4,3-c]pyrazole-3-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E146-1297
2-(diethylamino)ethyl 4-{1-methyl-1H,4H-chromeno[4,3-c]pyrazole-3-amido}benzoate

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

E146-1297

Molecular Formula

C25H28N4O4 (C25 H28 N4 O4)

Compound Name

2-(diethylamino)ethyl 4-{1-methyl-1H,4H-chromeno[4,3-c]pyrazole-3-amido}benzoate

IUPAC name

2-(diethylamino)ethyl 4-{1-methyl-1H4H-chromeno[43-c]pyrazole-3-amido}benzoate

SMILES

CCN(CC)CCOC(c(cc1)ccc1NC(c1nn(C)c-2c1COc1c2cccc1)=O)=O

InChI

InChI=1S/C25H28N4O4/c1-4-29(5-2)14-15-32-25(31)17-10-12-18(13-11-17)26-24(30)22-20-16-33-21-9-7-6-8-19(21)23(20)28(3)27-22/h6-13H,4-5,14-16H2,1-3H3,(H,26,30)

InChI Key

DNBTYSQTPKVZSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14843043

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.811

Distribution Coefficient, logD

2.842

Water Solubility, LogSw

-3.95

Polar Surface Area

70.561

Acid Dissociation Constant (pKa)

10.10

Base Dissociation Constant (pKb)

8.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

E146-1297 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

SH2 Library (10483 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Cancer
  • Endocrine
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E146-1297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E146-1297?
Check Price and Availability of E146-1297, 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 E146-1297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E146-1297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E146-1297
  • 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 E146-1297 available by request