G740-0128 Screening compound: 2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxo-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[(2-methoxyphenyl)methyl]acetamide

G740-0128 Screening compound: 2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxo-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[(2-methoxyphenyl)methyl]acetamide
G740-0128 Screening compound: 2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxo-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[(2-methoxyphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G740-0128
2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxo-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[(2-methoxyphenyl)methyl]acetamide

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

G740-0128

Molecular Formula

C23H22ClN5O3 (C23 H22 ClN5 O3)

Compound Name

2-[2-(4-chlorophenyl)-3,7-dimethyl-4-oxo-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl]-N-[(2-methoxyphenyl)methyl]acetamide

IUPAC name

2-[2-(4-chlorophenyl)-37-dimethyl-4-oxo-2H4H5H-pyrazolo[34-d]pyridazin-5-yl]-N-[(2-methoxyphenyl)methyl]acetamide

SMILES

Cc(n(-c(cc1)ccc1Cl)nc1C(C)=NN2CC(NCc(cccc3)c3OC)=O)c1C2=O

InChI

InChI=1S/C23H22ClN5O3/c1-14-22-21(15(2)29(27-22)18-10-8-17(24)9-11-18)23(31)28(26-14)13-20(30)25-12-16-6-4-5-7-19(16)32-3/h4-11H,12-13H2,1-3H3,(H,25,30)

InChI Key

RHNLLAXFBJNDMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15030954

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.380

Distribution Coefficient, logD

3.380

Water Solubility, LogSw

-4.12

Polar Surface Area

73.444

Acid Dissociation Constant (pKa)

13.63

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

G740-0128 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Human Proteases Annotated Library (2868 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

References: we are preparing a list of scientific research reports with G740-0128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G740-0128?
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What is the minimum amount of G740-0128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G740-0128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G740-0128
  • 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 G740-0128 available by request