C146-0664 Screening compound: (6Z)-6-({3,5-dimethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-5-imino-3-(methylsulfanyl)-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

C146-0664 Screening compound: (6Z)-6-({3,5-dimethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-5-imino-3-(methylsulfanyl)-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
C146-0664 Screening compound: (6Z)-6-({3,5-dimethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-5-imino-3-(methylsulfanyl)-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C146-0664
(6Z)-6-({3,5-dimethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-5-imino-3-(methylsulfanyl)-5H,6H,7H-[1,2,4]thiadiazolo[4,5-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

C146-0664

Molecular Formula

C24H24N4O5S2 (C24 H24 N4 O5 S2)

Compound Name

(6Z)-6-({3,5-dimethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-5-imino-3-(methylsulfanyl)-5H,6H,7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one

IUPAC name

(6Z)-6-({35-dimethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-5-imino-3-(methylsulfanyl)-5H6H7H-[124]thiadiazolo[45-a]pyrimidin-7-one

SMILES

Cc1cccc(OCCOc(c(OC)cc(/C=C(/C(N(C(SC)=NS2)C2=N2)=N)\C2=O)c2)c2OC)c1

InChI

InChI=1S/C24H24N4O5S2/c1-14-6-5-7-16(10-14)32-8-9-33-20-18(30-2)12-15(13-19(20)31-3)11-17-21(25)28-23(26-22(17)29)35-27-24(28)34-4/h5-7,10-13,25H,8-9H2,1-4H3

InChI Key

QFLOOEKDESJYNK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14722309

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

512.61

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.706

Distribution Coefficient, logD

3.694

Water Solubility, LogSw

-4.00

Polar Surface Area

82.466

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

5.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with C146-0664 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C146-0664?
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What is the minimum amount of C146-0664 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C146-0664
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C146-0664
  • 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 C146-0664 available by request