G854-0136 Screening compound: N-[(3-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-5-sulfonamide

G854-0136 Screening compound: N-[(3-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-5-sulfonamide
G854-0136 Screening compound: N-[(3-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G854-0136
N-[(3-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-5-sulfonamide

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

G854-0136

Molecular Formula

C16H16N2O4S (C16 H16 N2 O4 S)

Compound Name

N-[(3-methoxyphenyl)methyl]-3-oxo-2,3-dihydro-1H-isoindole-5-sulfonamide

IUPAC name

N-[(3-methoxyphenyl)methyl]-3-oxo-23-dihydro-1H-isoindole-5-sulfonamide

SMILES

COc1cccc(CNS(c2cc(C(NC3)=O)c3cc2)(=O)=O)c1

InChI

InChI=1S/C16H16N2O4S/c1-22-13-4-2-3-11(7-13)9-18-23(20,21)14-6-5-12-10-17-16(19)15(12)8-14/h2-8,18H,9-10H2,1H3,(H,17,19)

InChI Key

HRBMRSPXNSQGAJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15040942

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.051

Distribution Coefficient, logD

2.050

Water Solubility, LogSw

-2.81

Polar Surface Area

74.838

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

-4.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

G854-0136 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G854-0136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G854-0136?
Check Price and Availability of G854-0136, 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 G854-0136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G854-0136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G854-0136
  • 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 G854-0136 available by request