C066-0208 Screening compound: N-butyl-2-{[3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}-N-methylacetamide

C066-0208 Screening compound: N-butyl-2-{[3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}-N-methylacetamide
C066-0208 Screening compound: N-butyl-2-{[3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-0208
N-butyl-2-{[3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}-N-methylacetamide

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

C066-0208

Molecular Formula

C24H28N4O5 (C24 H28 N4 O5)

Compound Name

N-butyl-2-{[3-(2,4-dimethoxyphenyl)-4-oxo-3,4-dihydrophthalazin-1-yl]formamido}-N-methylacetamide

IUPAC name

N-butyl-2-{[3-(24-dimethoxyphenyl)-4-oxo-34-dihydrophthalazin-1-yl]formamido}-N-methylacetamide

SMILES

CCCCN(C)C(CNC(C(c1c2cccc1)=NN(c(ccc(OC)c1)c1OC)C2=O)=O)=O

InChI

InChI=1S/C24H28N4O5/c1-5-6-13-27(2)21(29)15-25-23(30)22-17-9-7-8-10-18(17)24(31)28(26-22)19-12-11-16(32-3)14-20(19)33-4/h7-12,14H,5-6,13,15H2,1-4H3,(H,25,30)

InChI Key

GBCBHTSJPFSFSD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14714311

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.445

Distribution Coefficient, logD

2.444

Water Solubility, LogSw

-3.05

Polar Surface Area

81.479

Acid Dissociation Constant (pKa)

11.38

Base Dissociation Constant (pKb)

4.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

C066-0208 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CORONAVIRUS Library (20774 compounds)

Dark Chemical Matter Library (18430 compounds)

PLpro Library (6343 compounds)

Aurora A-B Kinases Targeted Library (9426 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
  • Pool
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C066-0208 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-0208?
Check Price and Availability of C066-0208, 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 C066-0208 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-0208
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-0208
  • 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 C066-0208 available by request