V014-3528 Screening compound: 1-benzyl-N-[(2-methylphenyl)methyl]-4-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-3-carboxamide

V014-3528 Screening compound: 1-benzyl-N-[(2-methylphenyl)methyl]-4-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-3-carboxamide
V014-3528 Screening compound: 1-benzyl-N-[(2-methylphenyl)methyl]-4-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-3528
1-benzyl-N-[(2-methylphenyl)methyl]-4-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-3-carboxamide

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

V014-3528

Molecular Formula

C26H22N4OS (C26 H22 N4 OS)

Compound Name

1-benzyl-N-[(2-methylphenyl)methyl]-4-(thiophen-2-yl)-1H-pyrazolo[3,4-b]pyridine-3-carboxamide

IUPAC name

1-benzyl-N-[(2-methylphenyl)methyl]-4-(thiophen-2-yl)-1H-pyrazolo[34-b]pyridine-3-carboxamide

SMILES

Cc1c(CNC(c2nn(Cc3ccccc3)c3nccc(-c4cccs4)c23)=O)cccc1

InChI

InChI=1S/C26H22N4OS/c1-18-8-5-6-11-20(18)16-28-26(31)24-23-21(22-12-7-15-32-22)13-14-27-25(23)30(29-24)17-19-9-3-2-4-10-19/h2-15H,16-17H2,1H3,(H,28,31)

InChI Key

KGHAQZDOHPQWLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19955502

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

438.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.373

Distribution Coefficient, logD

5.373

Water Solubility, LogSw

-5.50

Polar Surface Area

49.284

Acid Dissociation Constant (pKa)

13.43

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

References: we are preparing a list of scientific research reports with V014-3528 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-3528?
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What is the minimum amount of V014-3528 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-3528
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-3528
  • 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 V014-3528 available by request