S565-1201 Screening compound: 1-methyl-N-(3-methylphenyl)-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxamide

S565-1201 Screening compound: 1-methyl-N-(3-methylphenyl)-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxamide
S565-1201 Screening compound: 1-methyl-N-(3-methylphenyl)-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S565-1201
1-methyl-N-(3-methylphenyl)-3-(4-phenyl-4H-1,2,4-triazol-3-yl)-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

S565-1201

Molecular Formula

C23H23N7O (C23 H23 N7 O)

Compound Name

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

IUPAC name

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

SMILES

Cc1cccc(NC(N(CC2)Cc3c2n(C)nc3-c2nncn2-c2ccccc2)=O)c1

InChI

InChI=1S/C23H23N7O/c1-16-7-6-8-17(13-16)25-23(31)29-12-11-20-19(14-29)21(27-28(20)2)22-26-24-15-30(22)18-9-4-3-5-10-18/h3-10,13,15H,11-12,14H2,1-2H3,(H,25,31)

InChI Key

AIXAOYIYTIMUOT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31988933

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.480

Distribution Coefficient, logD

2.479

Water Solubility, LogSw

-2.96

Polar Surface Area

64.931

Acid Dissociation Constant (pKa)

14.25

Base Dissociation Constant (pKb)

4.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.74

S565-1201 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)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S565-1201 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S565-1201?
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What is the minimum amount of S565-1201 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S565-1201
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S565-1201
  • 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 S565-1201 available by request