G944-0616 Screening compound: N-{1-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}benzenesulfonamide

G944-0616 Screening compound: N-{1-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}benzenesulfonamide
G944-0616 Screening compound: N-{1-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G944-0616
N-{1-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}benzenesulfonamide

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

G944-0616

Molecular Formula

C23H26N6O3S (C23 H26 N6 O3 S)

Compound Name

N-{1-[3-(1-cyclopentyl-1H-1,2,3-benzotriazol-5-yl)-1,2,4-oxadiazol-5-yl]-2-methylpropyl}benzenesulfonamide

IUPAC name

N-{1-[3-(1-cyclopentyl-1H-123-benzotriazol-5-yl)-124-oxadiazol-5-yl]-2-methylpropyl}benzenesulfonamide

SMILES

CC(C)C(c1nc(-c(cc2)cc3c2n(C2CCCC2)nn3)no1)NS(c1ccccc1)(=O)=O

InChI

InChI=1S/C23H26N6O3S/c1-15(2)21(27-33(30,31)18-10-4-3-5-11-18)23-24-22(26-32-23)16-12-13-20-19(14-16)25-28-29(20)17-8-6-7-9-17/h3-5,10-15,17,21,27H,6-9H2,1-2H3/t21-/m0/s1

InChI Key

GUQIFOHXKKGQDS-NRFANRHFSA-N

MDL Number (MFCD)

MFCD27169313

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.56

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.987

Distribution Coefficient, logD

4.907

Water Solubility, LogSw

-4.58

Polar Surface Area

99.001

Acid Dissociation Constant (pKa)

8.10

Base Dissociation Constant (pKb)

-1.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

39.10

G944-0616 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G944-0616 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G944-0616?
Check Price and Availability of G944-0616, 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 G944-0616 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G944-0616
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G944-0616
  • 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 G944-0616 available by request