3261-0033 Screening compound: ethyl 2-(1-oxo-4-phenyl-1,2-dihydrophthalazin-2-yl)acetate

3261-0033 Screening compound: ethyl 2-(1-oxo-4-phenyl-1,2-dihydrophthalazin-2-yl)acetate
3261-0033 Screening compound: ethyl 2-(1-oxo-4-phenyl-1,2-dihydrophthalazin-2-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3261-0033
ethyl 2-(1-oxo-4-phenyl-1,2-dihydrophthalazin-2-yl)acetate

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

3261-0033

Molecular Formula

C18H16N2O3 (C18 H16 N2 O3)

Compound Name

ethyl 2-(1-oxo-4-phenyl-1,2-dihydrophthalazin-2-yl)acetate

IUPAC name

ethyl 2-(1-oxo-4-phenyl-12-dihydrophthalazin-2-yl)acetate

SMILES

CCOC(CN1N=C(c2ccccc2)c(cccc2)c2C1=O)=O

InChI

InChI=1S/C18H16N2O3/c1-2-23-16(21)12-20-18(22)15-11-7-6-10-14(15)17(19-20)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3

InChI Key

YRMMNFZTLRYVJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00227406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.34

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.452

Distribution Coefficient, logD

2.452

Water Solubility, LogSw

-2.84

Polar Surface Area

47.625

Acid Dissociation Constant (pKa)

18.04

Base Dissociation Constant (pKb)

3.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

3261-0033 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

GABA Library (7115 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Eye
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 3261-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3261-0033?
Check Price and Availability of 3261-0033, 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 3261-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3261-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3261-0033
  • 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 3261-0033 available by request