4384-0249 Screening compound: (6Z)-5-imino-6-({3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-3-phenyl-5H,6H,7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one

4384-0249 Screening compound: (6Z)-5-imino-6-({3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-3-phenyl-5H,6H,7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
4384-0249 Screening compound: (6Z)-5-imino-6-({3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-3-phenyl-5H,6H,7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4384-0249
(6Z)-5-imino-6-({3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-3-phenyl-5H,6H,7H-[1,3]thiazolo[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

4384-0249

Molecular Formula

C29H25N3O4S (C29 H25 N3 O4 S)

Compound Name

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

IUPAC name

(6Z)-5-imino-6-({3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene)-3-phenyl-5H6H7H-[13]thiazolo[32-a]pyrimidin-7-one

SMILES

Cc(cccc1)c1OCCOc(ccc(/C=C(/C(N(C(c1ccccc1)=CS1)C1=N1)=N)\C1=O)c1)c1OC

InChI

InChI=1S/C29H25N3O4S/c1-19-8-6-7-11-24(19)35-14-15-36-25-13-12-20(17-26(25)34-2)16-22-27(30)32-23(21-9-4-3-5-10-21)18-37-29(32)31-28(22)33/h3-13,16-18,30H,14-15H2,1-2H3

InChI Key

XDWISGNBNWNQGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02985258

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

511.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.753

Distribution Coefficient, logD

4.749

Water Solubility, LogSw

-4.66

Polar Surface Area

64.840

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.80

References: we are preparing a list of scientific research reports with 4384-0249 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4384-0249?
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What is the minimum amount of 4384-0249 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4384-0249
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4384-0249
  • 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 4384-0249 available by request