C679-5629 Screening compound: 2-(4-methoxyphenoxy)-N-[4-({2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide

C679-5629 Screening compound: 2-(4-methoxyphenoxy)-N-[4-({2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide
C679-5629 Screening compound: 2-(4-methoxyphenoxy)-N-[4-({2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C679-5629
2-(4-methoxyphenoxy)-N-[4-({2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide

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

C679-5629

Molecular Formula

C23H21N3O5S (C23 H21 N3 O5 S)

Compound Name

2-(4-methoxyphenoxy)-N-[4-({2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide

IUPAC name

2-(4-methoxyphenoxy)-N-[4-({2-methyl-5-oxo-5H-[13]thiazolo[32-a]pyrimidin-7-yl}methoxy)phenyl]acetamide

SMILES

CC(SC1=NC(COc(cc2)ccc2NC(COc(cc2)ccc2OC)=O)=C2)=CN1C2=O

InChI

InChI=1S/C23H21N3O5S/c1-15-12-26-22(28)11-17(25-23(26)32-15)13-30-19-5-3-16(4-6-19)24-21(27)14-31-20-9-7-18(29-2)8-10-20/h3-12H,13-14H2,1-2H3,(H,24,27)

InChI Key

CYQSVKKGAVOTQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27643823

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.970

Distribution Coefficient, logD

2.970

Water Solubility, LogSw

-3.54

Polar Surface Area

71.861

Acid Dissociation Constant (pKa)

12.34

Base Dissociation Constant (pKb)

1.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

C679-5629 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C679-5629 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C679-5629?
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What is the minimum amount of C679-5629 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C679-5629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C679-5629
  • 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 C679-5629 available by request