3773-1797 Screening compound: (6Z)-6-({4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}methylidene)-5-imino-2-propyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

3773-1797 Screening compound: (6Z)-6-({4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}methylidene)-5-imino-2-propyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
3773-1797 Screening compound: (6Z)-6-({4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}methylidene)-5-imino-2-propyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3773-1797
(6Z)-6-({4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}methylidene)-5-imino-2-propyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-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

3773-1797

Molecular Formula

C27H30N4O4S (C27 H30 N4 O4 S)

Compound Name

(6Z)-6-({4-[2-(3,4-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}methylidene)-5-imino-2-propyl-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

IUPAC name

(6Z)-6-({4-[2-(34-dimethylphenoxy)ethoxy]-3-ethoxyphenyl}methylidene)-5-imino-2-propyl-5H6H7H-[134]thiadiazolo[32-a]pyrimidin-7-one

SMILES

CCCC(SC1=NC(/C2=C\c(cc3)cc(OCC)c3OCCOc3cc(C)c(C)cc3)=O)=NN1C2=N

InChI

InChI=1S/C27H30N4O4S/c1-5-7-24-30-31-25(28)21(26(32)29-27(31)36-24)15-19-9-11-22(23(16-19)33-6-2)35-13-12-34-20-10-8-17(3)18(4)14-20/h8-11,14-16,28H,5-7,12-13H2,1-4H3

InChI Key

RELJRGZUQLPLHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02118472

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

506.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.161

Distribution Coefficient, logD

3.686

Water Solubility, LogSw

-5.00

Polar Surface Area

76.783

Acid Dissociation Constant (pKa)

23.95

Base Dissociation Constant (pKb)

8.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

3773-1797 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 3773-1797 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3773-1797?
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What is the minimum amount of 3773-1797 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3773-1797
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3773-1797
  • 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 3773-1797 available by request