G857-1796 Screening compound: 5-[(2-fluorophenyl)(3-methylpiperidin-1-yl)methyl]-2-(furan-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol

G857-1796 Screening compound: 5-[(2-fluorophenyl)(3-methylpiperidin-1-yl)methyl]-2-(furan-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol
G857-1796 Screening compound: 5-[(2-fluorophenyl)(3-methylpiperidin-1-yl)methyl]-2-(furan-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound G857-1796
5-[(2-fluorophenyl)(3-methylpiperidin-1-yl)methyl]-2-(furan-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol

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

G857-1796

Molecular Formula

C21H21FN4O2S (C21 H21 FN4 O2 S)

Compound Name

5-[(2-fluorophenyl)(3-methylpiperidin-1-yl)methyl]-2-(furan-2-yl)-[1,2,4]triazolo[3,2-b][1,3]thiazol-6-ol

IUPAC name

5-[(2-fluorophenyl)(3-methylpiperidin-1-yl)methyl]-2-(furan-2-yl)-[124]triazolo[32-b][13]thiazol-6-ol

SMILES

CC(CCC1)CN1C(c(sc1nc(-c2ccco2)nn11)c1O)c(cccc1)c1F

InChI

InChI=1S/C21H21FN4O2S/c1-13-6-4-10-25(12-13)17(14-7-2-3-8-15(14)22)18-20(27)26-21(29-18)23-19(24-26)16-9-5-11-28-16/h2-3,5,7-9,11,13,17,27H,4,6,10,12H2,1H3

InChI Key

XNDPENLGZFYLEA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06749118

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.087

Distribution Coefficient, logD

4.087

Water Solubility, LogSw

-4.02

Polar Surface Area

48.405

Acid Dissociation Constant (pKa)

4.34

Base Dissociation Constant (pKb)

8.94

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with G857-1796 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G857-1796?
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What is the minimum amount of G857-1796 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G857-1796
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G857-1796
  • 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 G857-1796 available by request