C679-4362 Screening compound: N-[3-({2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]-2-methylpropanamide

C679-4362 Screening compound: N-[3-({2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]-2-methylpropanamide
C679-4362 Screening compound: N-[3-({2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C679-4362
N-[3-({2-ethyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]-2-methylpropanamide

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

C679-4362

Molecular Formula

C18H20N4O3S (C18 H20 N4 O3 S)

Compound Name

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

IUPAC name

N-[3-({2-ethyl-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methoxy)phenyl]-2-methylpropanamide

SMILES

CCC(SC1=NC(COc2cc(NC(C(C)C)=O)ccc2)=C2)=NN1C2=O

InChI

InChI=1S/C18H20N4O3S/c1-4-15-21-22-16(23)9-13(20-18(22)26-15)10-25-14-7-5-6-12(8-14)19-17(24)11(2)3/h5-9,11H,4,10H2,1-3H3,(H,19,24)

InChI Key

VAYQLADHXPWTHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14781737

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

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.896

Distribution Coefficient, logD

2.889

Water Solubility, LogSw

-3.40

Polar Surface Area

69.036

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

5.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with C679-4362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C679-4362?
Check Price and Availability of C679-4362, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C679-4362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C679-4362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C679-4362
  • 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 C679-4362 available by request