J013-1710 Screening compound: 4-(4-fluoro-3-methoxybenzoyl)-1-(4-methoxyphenyl)-3-methyl-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of ChemDiv screening compound J013-1710
4-(4-fluoro-3-methoxybenzoyl)-1-(4-methoxyphenyl)-3-methyl-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
J013-1710
Molecular Formula
C22H20FN3O4 (C22 H20 FN3 O4)
Compound Name
4-(4-fluoro-3-methoxybenzoyl)-1-(4-methoxyphenyl)-3-methyl-1H,4H,5H,6H,7H-pyrazolo[3,4-b]pyridin-6-one
IUPAC name
4-(4-fluoro-3-methoxybenzoyl)-1-(4-methoxyphenyl)-3-methyl-1H4H5H6H7H-pyrazolo[34-b]pyridin-6-one
SMILES
Cc(c(C(C1)C(c(cc2)cc(OC)c2F)=O)c2NC1=O)nn2-c(cc1)ccc1OC
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
409.42
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
2.836
Distribution Coefficient, logD
2.824
Water Solubility, LogSw
-3.49
Polar Surface Area
68.004
Acid Dissociation Constant (pKa)
8.96
Base Dissociation Constant (pKb)
-2.38
Number of Chiral Centers
1.00
Percent sp3 carbon bonding
22.70
J013-1710 in Drug Discovery
Included in Screening Libraries
Nucleic Acid Ligands (8311 compounds)
Included in 1.7M Stock Database
- Infections
- Cancer
- Musculoskeletal
- Nervous system
- Hemic and lymphatic
- Immune system
References: we are preparing a list of scientific research reports with J013-1710 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)