8018-4899 Screening compound: 2-{2-[3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenyl}-1,3-benzothiazole

8018-4899 Screening compound: 2-{2-[3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenyl}-1,3-benzothiazole
8018-4899 Screening compound: 2-{2-[3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenyl}-1,3-benzothiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-4899
2-{2-[3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenyl}-1,3-benzothiazole

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

8018-4899

Molecular Formula

C22H11Cl2N5S2 (C22 H11 Cl2 N5 S2)

Compound Name

2-{2-[3-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]phenyl}-1,3-benzothiazole

IUPAC name

n/a

SMILES

Clc(cc1)cc(Cl)c1-c1nnc2sc(-c(cccc3)c3-c3nc(cccc4)c4s3)nn12

InChI

InChI=1S/C22H11Cl2N5S2/c23-12-9-10-15(16(24)11-12)19-26-27-22-29(19)28-21(31-22)14-6-2-1-5-13(14)20-25-17-7-3-4-8-18(17)30-20/h1-11H

InChI Key

MHYYIVOFKMLNNE-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.543

Distribution Coefficient, logD

6.543

Water Solubility, LogSw

-6.82

Polar Surface Area

43.170

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

2.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8018-4899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-4899?
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What is the minimum amount of 8018-4899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-4899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-4899
  • 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 8018-4899 available by request