G072-1718 Screening compound: 4-methoxy-N-{2-[({5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide

G072-1718 Screening compound: 4-methoxy-N-{2-[({5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide
G072-1718 Screening compound: 4-methoxy-N-{2-[({5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G072-1718
4-methoxy-N-{2-[({5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}benzamide

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

G072-1718

Molecular Formula

C23H22N4O3S2 (C23 H22 N4 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

CCCC(SC1=NC(CSc(cccc2)c2NC(c(cc2)ccc2OC)=O)=C2)=NN1C2=O

InChI

InChI=1S/C23H22N4O3S2/c1-3-6-20-26-27-21(28)13-16(24-23(27)32-20)14-31-19-8-5-4-7-18(19)25-22(29)15-9-11-17(30-2)12-10-15/h4-5,7-13H,3,6,14H2,1-2H3,(H,25,29)

InChI Key

GKIBJJWZAONHNL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14980212

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.403

Distribution Coefficient, logD

4.401

Water Solubility, LogSw

-4.26

Polar Surface Area

68.111

Acid Dissociation Constant (pKa)

11.22

Base Dissociation Constant (pKb)

5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with G072-1718 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-1718?
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What is the minimum amount of G072-1718 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-1718
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-1718
  • 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 G072-1718 available by request