6764-0246 Screening compound: (2Z)-6-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

6764-0246 Screening compound: (2Z)-6-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
6764-0246 Screening compound: (2Z)-6-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 6764-0246
(2Z)-6-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

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

6764-0246

Molecular Formula

C19H11ClFN3O2S (C19 H11 ClFN3 O2 S)

Compound Name

(2Z)-6-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylidene]-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

IUPAC name

(2Z)-6-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylidene]-2H3H7H-[13]thiazolo[32-b][124]triazine-37-dione

SMILES

O=C(/C(/SC1=N2)=C/c(cccc3)c3F)N1N=C(Cc(cc1)ccc1Cl)C2=O

InChI

InChI=1S/C19H11ClFN3O2S/c20-13-7-5-11(6-8-13)9-15-17(25)22-19-24(23-15)18(26)16(27-19)10-12-3-1-2-4-14(12)21/h1-8,10H,9H2

InChI Key

RURLJPIRUBIDJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04448080

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.83

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.903

Distribution Coefficient, logD

3.903

Water Solubility, LogSw

-4.56

Polar Surface Area

50.552

Acid Dissociation Constant (pKa)

20.99

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

References: we are preparing a list of scientific research reports with 6764-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6764-0246?
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What is the minimum amount of 6764-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6764-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6764-0246
  • 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 6764-0246 available by request