G857-1945 Screening compound: methyl 1-[(furan-2-yl)[2-(furan-2-yl)-6-hydroxy-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl]methyl]piperidine-4-carboxylate

G857-1945 Screening compound: methyl 1-[(furan-2-yl)[2-(furan-2-yl)-6-hydroxy-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl]methyl]piperidine-4-carboxylate
G857-1945 Screening compound: methyl 1-[(furan-2-yl)[2-(furan-2-yl)-6-hydroxy-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl]methyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G857-1945
methyl 1-[(furan-2-yl)[2-(furan-2-yl)-6-hydroxy-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl]methyl]piperidine-4-carboxylate

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

G857-1945

Molecular Formula

C20H20N4O5S (C20 H20 N4 O5 S)

Compound Name

methyl 1-[(furan-2-yl)[2-(furan-2-yl)-6-hydroxy-[1,2,4]triazolo[3,2-b][1,3]thiazol-5-yl]methyl]piperidine-4-carboxylate

IUPAC name

methyl 1-[(furan-2-yl)[2-(furan-2-yl)-6-hydroxy-[124]triazolo[32-b][13]thiazol-5-yl]methyl]piperidine-4-carboxylate

SMILES

COC(C(CC1)CCN1C(c1ccco1)c(sc1nc(-c2ccco2)nn11)c1O)=O

InChI

InChI=1S/C20H20N4O5S/c1-27-19(26)12-6-8-23(9-7-12)15(13-4-2-10-28-13)16-18(25)24-20(30-16)21-17(22-24)14-5-3-11-29-14/h2-5,10-12,15,25H,6-9H2,1H3/t15-/m0/s1

InChI Key

AHULHWOOSCUJSC-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD07646125

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.216

Distribution Coefficient, logD

2.216

Water Solubility, LogSw

-2.34

Polar Surface Area

78.224

Acid Dissociation Constant (pKa)

4.31

Base Dissociation Constant (pKb)

8.87

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with G857-1945 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G857-1945?
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What is the minimum amount of G857-1945 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G857-1945
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G857-1945
  • 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 G857-1945 available by request