C726-1923 Screening compound: (6E)-5-imino-6-({4-[(2-methylphenyl)methoxy]phenyl}methylidene)-2-(morpholin-4-yl)-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

C726-1923 Screening compound: (6E)-5-imino-6-({4-[(2-methylphenyl)methoxy]phenyl}methylidene)-2-(morpholin-4-yl)-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
C726-1923 Screening compound: (6E)-5-imino-6-({4-[(2-methylphenyl)methoxy]phenyl}methylidene)-2-(morpholin-4-yl)-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C726-1923
(6E)-5-imino-6-({4-[(2-methylphenyl)methoxy]phenyl}methylidene)-2-(morpholin-4-yl)-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

C726-1923

Molecular Formula

C24H23N5O3S (C24 H23 N5 O3 S)

Compound Name

(6E)-5-imino-6-({4-[(2-methylphenyl)methoxy]phenyl}methylidene)-2-(morpholin-4-yl)-5H,6H,7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

IUPAC name

(6E)-5-imino-6-({4-[(2-methylphenyl)methoxy]phenyl}methylidene)-2-(morpholin-4-yl)-5H6H7H-[134]thiadiazolo[32-a]pyrimidin-7-one

SMILES

Cc1c(COc2ccc(/C=C(\C(N3N=C(N4CCOCC4)SC3=N3)=N)/C3=O)cc2)cccc1

InChI

InChI=1S/C24H23N5O3S/c1-16-4-2-3-5-18(16)15-32-19-8-6-17(7-9-19)14-20-21(25)29-23(26-22(20)30)33-24(27-29)28-10-12-31-13-11-28/h2-9,14,25H,10-13,15H2,1H3

InChI Key

VSYDYIBZFCGDCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14788524

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.543

Distribution Coefficient, logD

1.044

Water Solubility, LogSw

-3.55

Polar Surface Area

73.191

Acid Dissociation Constant (pKa)

28.43

Base Dissociation Constant (pKb)

9.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with C726-1923 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C726-1923?
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What is the minimum amount of C726-1923 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C726-1923
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C726-1923
  • 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 C726-1923 available by request