8017-1055 Screening compound: 3-(4-chlorophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one

8017-1055 Screening compound: 3-(4-chlorophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
8017-1055 Screening compound: 3-(4-chlorophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-1055
3-(4-chlorophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-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

8017-1055

Molecular Formula

C17H10ClN3OS (C17 H10 ClN3 OS)

Compound Name

3-(4-chlorophenyl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one

IUPAC name

3-(4-chlorophenyl)-7-phenyl-5H-[124]triazolo[34-b][13]thiazin-5-one

SMILES

O=C(C=C(c1ccccc1)S1)n2c1nnc2-c(cc1)ccc1Cl

InChI

InChI=1S/C17H10ClN3OS/c18-13-8-6-12(7-9-13)16-19-20-17-21(16)15(22)10-14(23-17)11-4-2-1-3-5-11/h1-10H

InChI Key

YGEZINOAUPOHGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06014105

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.8

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.045

Distribution Coefficient, logD

4.045

Water Solubility, LogSw

-4.61

Polar Surface Area

37.856

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-3.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8017-1055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-1055?
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What is the minimum amount of 8017-1055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-1055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-1055
  • 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 8017-1055 available by request