C679-6511 Screening compound: 3-methyl-N-[3-({5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]butanamide

C679-6511 Screening compound: 3-methyl-N-[3-({5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]butanamide
C679-6511 Screening compound: 3-methyl-N-[3-({5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C679-6511
3-methyl-N-[3-({5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methoxy)phenyl]butanamide

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

C679-6511

Molecular Formula

C20H24N4O3S (C20 H24 N4 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCCC(SC1=NC(COc2cc(NC(CC(C)C)=O)ccc2)=C2)=NN1C2=O

InChI

InChI=1S/C20H24N4O3S/c1-4-6-18-23-24-19(26)11-15(22-20(24)28-18)12-27-16-8-5-7-14(10-16)21-17(25)9-13(2)3/h5,7-8,10-11,13H,4,6,9,12H2,1-3H3,(H,21,25)

InChI Key

RBRBHQYVCFVPLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14782150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.891

Distribution Coefficient, logD

3.887

Water Solubility, LogSw

-4.05

Polar Surface Area

68.823

Acid Dissociation Constant (pKa)

11.61

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with C679-6511 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C679-6511?
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What is the minimum amount of C679-6511 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C679-6511
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C679-6511
  • 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 C679-6511 available by request