5606-4306 Screening compound: (2E)-2-[(3-ethoxy-4-propoxyphenyl)methylidene]-6-methyl-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

5606-4306 Screening compound: (2E)-2-[(3-ethoxy-4-propoxyphenyl)methylidene]-6-methyl-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
5606-4306 Screening compound: (2E)-2-[(3-ethoxy-4-propoxyphenyl)methylidene]-6-methyl-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 5606-4306
(2E)-2-[(3-ethoxy-4-propoxyphenyl)methylidene]-6-methyl-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

5606-4306

Molecular Formula

C18H19N3O4S (C18 H19 N3 O4 S)

Compound Name

(2E)-2-[(3-ethoxy-4-propoxyphenyl)methylidene]-6-methyl-2H,3H,7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

IUPAC name

(2E)-2-[(3-ethoxy-4-propoxyphenyl)methylidene]-6-methyl-2H3H7H-[13]thiazolo[32-b][124]triazine-37-dione

SMILES

CCCOc(ccc(/C=C(\C(N1N=C2C)=O)/SC1=NC2=O)c1)c1OCC

InChI

InChI=1S/C18H19N3O4S/c1-4-8-25-13-7-6-12(9-14(13)24-5-2)10-15-17(23)21-18(26-15)19-16(22)11(3)20-21/h6-7,9-10H,4-5,8H2,1-3H3

InChI Key

BDZVPITYSSWANF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03667230

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.456

Distribution Coefficient, logD

2.456

Water Solubility, LogSw

-2.69

Polar Surface Area

64.808

Acid Dissociation Constant (pKa)

27.49

Base Dissociation Constant (pKb)

-0.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

5606-4306 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 5606-4306 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5606-4306?
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What is the minimum amount of 5606-4306 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5606-4306
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5606-4306
  • 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 5606-4306 available by request