J013-1649 Screening compound: 4-(2,6-dimethoxybenzoyl)-3-methyl-1-(3-methylphenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

J013-1649 Screening compound: 4-(2,6-dimethoxybenzoyl)-3-methyl-1-(3-methylphenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
J013-1649 Screening compound: 4-(2,6-dimethoxybenzoyl)-3-methyl-1-(3-methylphenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J013-1649
4-(2,6-dimethoxybenzoyl)-3-methyl-1-(3-methylphenyl)-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

J013-1649

Molecular Formula

C23H23N3O4 (C23 H23 N3 O4)

Compound Name

4-(2,6-dimethoxybenzoyl)-3-methyl-1-(3-methylphenyl)-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one

IUPAC name

4-(26-dimethoxybenzoyl)-3-methyl-1-(3-methylphenyl)-1H4H5H6H7H-pyrazolo[34-b]pyridin-6-one

SMILES

Cc(c(C(C1)C(c(c(OC)ccc2)c2OC)=O)c2NC1=O)nn2-c1cc(C)ccc1

InChI

InChI=1S/C23H23N3O4/c1-13-7-5-8-15(11-13)26-23-20(14(2)25-26)16(12-19(27)24-23)22(28)21-17(29-3)9-6-10-18(21)30-4/h5-11,16H,12H2,1-4H3,(H,24,27)/t16-/m0/s1

InChI Key

RXPZYCBACULCPI-INIZCTEOSA-N

MDL Number (MFCD)

MFCD27217194

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.451

Distribution Coefficient, logD

2.446

Water Solubility, LogSw

-2.86

Polar Surface Area

68.091

Acid Dissociation Constant (pKa)

9.35

Base Dissociation Constant (pKb)

-1.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with J013-1649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J013-1649?
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What is the minimum amount of J013-1649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J013-1649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J013-1649
  • 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 J013-1649 available by request