5606-3909 Screening compound: (2Z)-2-[(2-butoxyphenyl)methylidene]-6-phenyl-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

5606-3909 Screening compound: (2Z)-2-[(2-butoxyphenyl)methylidene]-6-phenyl-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
5606-3909 Screening compound: (2Z)-2-[(2-butoxyphenyl)methylidene]-6-phenyl-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 5606-3909
(2Z)-2-[(2-butoxyphenyl)methylidene]-6-phenyl-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

5606-3909

Molecular Formula

C22H19N3O3S (C22 H19 N3 O3 S)

Compound Name

(2Z)-2-[(2-butoxyphenyl)methylidene]-6-phenyl-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

IUPAC name

(2Z)-2-[(2-butoxyphenyl)methylidene]-6-phenyl-2H3H7H-[13]thiazolo[32-b][124]triazine-37-dione

SMILES

CCCCOc1c(/C=C(/C(N2N=C3c4ccccc4)=O)\SC2=NC3=O)cccc1

InChI

InChI=1S/C22H19N3O3S/c1-2-3-13-28-17-12-8-7-11-16(17)14-18-21(27)25-22(29-18)23-20(26)19(24-25)15-9-5-4-6-10-15/h4-12,14H,2-3,13H2,1H3

InChI Key

AGDDSQAYFXZXBF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03664301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.772

Distribution Coefficient, logD

4.772

Water Solubility, LogSw

-4.58

Polar Surface Area

58.153

Acid Dissociation Constant (pKa)

27.52

Base Dissociation Constant (pKb)

2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 5606-3909 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5606-3909?
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What is the minimum amount of 5606-3909 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5606-3909
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5606-3909
  • 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 5606-3909 available by request