C679-5632 Screening compound: 2-(2-chlorophenoxy)-N-[4-({2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide

C679-5632 Screening compound: 2-(2-chlorophenoxy)-N-[4-({2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide
C679-5632 Screening compound: 2-(2-chlorophenoxy)-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 C679-5632
2-(2-chlorophenoxy)-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

C679-5632

Molecular Formula

C22H18ClN3O4S (C22 H18 ClN3 O4 S)

Compound Name

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

IUPAC name

2-(2-chlorophenoxy)-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(cccc2)c2Cl)=O)=C2)=CN1C2=O

InChI

InChI=1S/C22H18ClN3O4S/c1-14-11-26-21(28)10-16(25-22(26)31-14)12-29-17-8-6-15(7-9-17)24-20(27)13-30-19-5-3-2-4-18(19)23/h2-11H,12-13H2,1H3,(H,24,27)

InChI Key

CMARKBABFFFQNQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD26965445

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.92

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

3.382

Distribution Coefficient, logD

3.382

Water Solubility, LogSw

-3.62

Polar Surface Area

64.404

Acid Dissociation Constant (pKa)

12.34

Base Dissociation Constant (pKb)

1.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

C679-5632 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 C679-5632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C679-5632?
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What is the minimum amount of C679-5632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C679-5632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C679-5632
  • 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 C679-5632 available by request