G072-1203 Screening compound: N-{2-[({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-3-methylbutanamide

G072-1203 Screening compound: N-{2-[({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-3-methylbutanamide
G072-1203 Screening compound: N-{2-[({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G072-1203
N-{2-[({2-butyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-3-methylbutanamide

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

G072-1203

Molecular Formula

C21H26N4O2S2 (C21 H26 N4 O2 S2)

Compound Name

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

IUPAC name

N-{2-[({2-butyl-5-oxo-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}-3-methylbutanamide

SMILES

CCCCC(SC1=NC(CSc(cccc2)c2NC(CC(C)C)=O)=C2)=NN1C2=O

InChI

InChI=1S/C21H26N4O2S2/c1-4-5-10-19-24-25-20(27)12-15(22-21(25)29-19)13-28-17-9-7-6-8-16(17)23-18(26)11-14(2)3/h6-9,12,14H,4-5,10-11,13H2,1-3H3,(H,23,26)

InChI Key

NHSWXIJMZZLXLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14979993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.460

Distribution Coefficient, logD

4.459

Water Solubility, LogSw

-4.16

Polar Surface Area

60.626

Acid Dissociation Constant (pKa)

12.04

Base Dissociation Constant (pKb)

4.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

References: we are preparing a list of scientific research reports with G072-1203 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-1203?
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What is the minimum amount of G072-1203 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-1203
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-1203
  • 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 G072-1203 available by request