G647-2356 Screening compound: 2-phenyl-5-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

G647-2356 Screening compound: 2-phenyl-5-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
G647-2356 Screening compound: 2-phenyl-5-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G647-2356
2-phenyl-5-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-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

G647-2356

Molecular Formula

C17H17N7OS (C17 H17 N7 OS)

Compound Name

2-phenyl-5-{[(5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-3H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

IUPAC name

2-phenyl-5-{[(5-propyl-4H-124-triazol-3-yl)sulfanyl]methyl}-3H7H-[124]triazolo[15-a]pyrimidin-7-one

SMILES

CCCc([nH]1)nnc1SCC(N=C1N2N=C(c3ccccc3)N1)=CC2=O

InChI

InChI=1S/C17H17N7OS/c1-2-6-13-19-17(22-21-13)26-10-12-9-14(25)24-16(18-12)20-15(23-24)11-7-4-3-5-8-11/h3-5,7-9H,2,6,10H2,1H3,(H,18,20,23)(H,19,21,22)

InChI Key

AYZBOLRCZSQAKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15025978

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.942

Distribution Coefficient, logD

1.942

Water Solubility, LogSw

-2.51

Polar Surface Area

85.693

Acid Dissociation Constant (pKa)

5.14

Base Dissociation Constant (pKb)

-7.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

G647-2356 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G647-2356 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G647-2356?
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What is the minimum amount of G647-2356 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G647-2356
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G647-2356
  • 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 G647-2356 available by request