G740-1038 Screening compound: N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-{3,7-dimethyl-4-oxo-2-phenyl-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl}acetamide

G740-1038 Screening compound: N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-{3,7-dimethyl-4-oxo-2-phenyl-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl}acetamide
G740-1038 Screening compound: N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-{3,7-dimethyl-4-oxo-2-phenyl-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G740-1038
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-{3,7-dimethyl-4-oxo-2-phenyl-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl}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

G740-1038

Molecular Formula

C22H24N6O3 (C22 H24 N6 O3)

Compound Name

N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-{3,7-dimethyl-4-oxo-2-phenyl-2H,4H,5H-pyrazolo[3,4-d]pyridazin-5-yl}acetamide

IUPAC name

N-[2-(35-dimethyl-12-oxazol-4-yl)ethyl]-2-{37-dimethyl-4-oxo-2-phenyl-2H4H5H-pyrazolo[34-d]pyridazin-5-yl}acetamide

SMILES

Cc(n(-c1ccccc1)nc1C(C)=NN2CC(NCCc3c(C)onc3C)=O)c1C2=O

InChI

InChI=1S/C22H24N6O3/c1-13-18(16(4)31-26-13)10-11-23-19(29)12-27-22(30)20-15(3)28(17-8-6-5-7-9-17)25-21(20)14(2)24-27/h5-9H,10-12H2,1-4H3,(H,23,29)

InChI Key

XLTWFSVRJGDFMC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27155116

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.449

Distribution Coefficient, logD

1.449

Water Solubility, LogSw

-2.19

Polar Surface Area

87.693

Acid Dissociation Constant (pKa)

15.40

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

G740-1038 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G740-1038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G740-1038?
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What is the minimum amount of G740-1038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G740-1038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G740-1038
  • 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 G740-1038 available by request