C679-4744 Screening compound: N-[4-({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide

C679-4744 Screening compound: N-[4-({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide
C679-4744 Screening compound: N-[4-({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C679-4744
N-[4-({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[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

C679-4744

Molecular Formula

C18H20N4O3S (C18 H20 N4 O3 S)

Compound Name

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

IUPAC name

N-[4-({2-butyl-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methoxy)phenyl]acetamide

SMILES

CCCCC(SC1=NC(COc(cc2)ccc2NC(C)=O)=C2)=NN1C2=O

InChI

InChI=1S/C18H20N4O3S/c1-3-4-5-16-21-22-17(24)10-14(20-18(22)26-16)11-25-15-8-6-13(7-9-15)19-12(2)23/h6-10H,3-5,11H2,1-2H3,(H,19,23)

InChI Key

MINFWIKGULJFMS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14781879

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.45

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

2.817

Distribution Coefficient, logD

2.816

Water Solubility, LogSw

-3.40

Polar Surface Area

68.935

Acid Dissociation Constant (pKa)

12.65

Base Dissociation Constant (pKb)

4.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with C679-4744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C679-4744?
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What is the minimum amount of C679-4744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C679-4744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C679-4744
  • 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 C679-4744 available by request