S565-1074 Screening compound: 3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-N-propyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxamide

S565-1074 Screening compound: 3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-N-propyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxamide
S565-1074 Screening compound: 3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-N-propyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S565-1074
3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-N-propyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-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

S565-1074

Molecular Formula

C20H25N7O (C20 H25 N7 O)

Compound Name

3-(4-benzyl-4H-1,2,4-triazol-3-yl)-1-methyl-N-propyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxamide

IUPAC name

3-(4-benzyl-4H-124-triazol-3-yl)-1-methyl-N-propyl-1H4H5H6H7H-pyrazolo[43-c]pyridine-5-carboxamide

SMILES

CCCNC(N(CC1)Cc2c1n(C)nc2-c1nncn1Cc1ccccc1)=O

InChI

InChI=1S/C20H25N7O/c1-3-10-21-20(28)26-11-9-17-16(13-26)18(24-25(17)2)19-23-22-14-27(19)12-15-7-5-4-6-8-15/h4-8,14H,3,9-13H2,1-2H3,(H,21,28)

InChI Key

AVIZVCPNNJFUTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31979829

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.481

Distribution Coefficient, logD

1.480

Water Solubility, LogSw

-2.01

Polar Surface Area

65.907

Acid Dissociation Constant (pKa)

17.06

Base Dissociation Constant (pKb)

4.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

S565-1074 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with S565-1074 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S565-1074?
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What is the minimum amount of S565-1074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S565-1074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S565-1074
  • 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 S565-1074 available by request