J081-1270 Screening compound: 4-[4-methoxy-3-(propan-2-yloxy)phenyl]-3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

J081-1270 Screening compound: 4-[4-methoxy-3-(propan-2-yloxy)phenyl]-3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
J081-1270 Screening compound: 4-[4-methoxy-3-(propan-2-yloxy)phenyl]-3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J081-1270
4-[4-methoxy-3-(propan-2-yloxy)phenyl]-3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

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

J081-1270

Molecular Formula

C27H28N6O3 (C27 H28 N6 O3)

Compound Name

4-[4-methoxy-3-(propan-2-yloxy)phenyl]-3-methyl-1-[5-(4-methylphenyl)-1,2,4-triazin-3-yl]-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

IUPAC name

4-[4-methoxy-3-(propan-2-yloxy)phenyl]-3-methyl-1-[5-(4-methylphenyl)-124-triazin-3-yl]-1H4H5H6H7H-pyrazolo[34-b]pyridin-6-one

SMILES

CC(C)Oc(cc(C(CC(N1)=O)c2c1n(-c1nncc(-c3ccc(C)cc3)n1)nc2C)cc1)c1OC

InChI

InChI=1S/C27H28N6O3/c1-15(2)36-23-12-19(10-11-22(23)35-5)20-13-24(34)30-26-25(20)17(4)32-33(26)27-29-21(14-28-31-27)18-8-6-16(3)7-9-18/h6-12,14-15,20H,13H2,1-5H3,(H,30,34)/t20-/m0/s1

InChI Key

JYTMUFFRIUPTET-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27644449

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.378

Distribution Coefficient, logD

4.377

Water Solubility, LogSw

-4.23

Polar Surface Area

84.894

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

3.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.60

J081-1270 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with J081-1270 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J081-1270?
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What is the minimum amount of J081-1270 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J081-1270
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J081-1270
  • 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 J081-1270 available by request