G072-1909 Screening compound: N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)-1,3-benzothiazol-6-yl]pentanamide

G072-1909 Screening compound: N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)-1,3-benzothiazol-6-yl]pentanamide
G072-1909 Screening compound: N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)-1,3-benzothiazol-6-yl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G072-1909
N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)-1,3-benzothiazol-6-yl]pentanamide

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

G072-1909

Molecular Formula

C21H23N5O2S3 (C21 H23 N5 O2 S3)

Compound Name

N-[2-({[5-oxo-2-(propan-2-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}sulfanyl)-1,3-benzothiazol-6-yl]pentanamide

IUPAC name

N-[2-({[5-oxo-2-(propan-2-yl)-5H-[134]thiadiazolo[32-a]pyrimidin-7-yl]methyl}sulfanyl)-13-benzothiazol-6-yl]pentanamide

SMILES

CCCCC(Nc(cc1)cc2c1nc(SCC(N=C1SC(C(C)C)=NN11)=CC1=O)s2)=O

InChI

InChI=1S/C21H23N5O2S3/c1-4-5-6-17(27)22-13-7-8-15-16(9-13)30-21(24-15)29-11-14-10-18(28)26-20(23-14)31-19(25-26)12(2)3/h7-10,12H,4-6,11H2,1-3H3,(H,22,27)

InChI Key

RNJKAECGOJDNGO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14980293

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.64

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

5.063

Distribution Coefficient, logD

5.059

Water Solubility, LogSw

-4.67

Polar Surface Area

70.502

Acid Dissociation Constant (pKa)

11.57

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

G072-1909 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G072-1909 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-1909?
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What is the minimum amount of G072-1909 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-1909
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-1909
  • 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 G072-1909 available by request