G237-0189 Screening compound: 2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-methoxy-5-methylphenyl)acetamide

G237-0189 Screening compound: 2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-methoxy-5-methylphenyl)acetamide
G237-0189 Screening compound: 2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-methoxy-5-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G237-0189
2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-methoxy-5-methylphenyl)acetamide

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

G237-0189

Molecular Formula

C25H25N3O4S2 (C25 H25 N3 O4 S2)

Compound Name

2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-methoxy-5-methylphenyl)acetamide

IUPAC name

2-(N-benzyl2-methyl-13-benzothiazole-6-sulfonamido)-N-(2-methoxy-5-methylphenyl)acetamide

SMILES

Cc1nc(ccc(S(N(CC(Nc(cc(C)cc2)c2OC)=O)Cc2ccccc2)(=O)=O)c2)c2s1

InChI

InChI=1S/C25H25N3O4S2/c1-17-9-12-23(32-3)22(13-17)27-25(29)16-28(15-19-7-5-4-6-8-19)34(30,31)20-10-11-21-24(14-20)33-18(2)26-21/h4-14H,15-16H2,1-3H3,(H,27,29)

InChI Key

IYCINQHMLWBPJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14989114

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.62

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

4.637

Distribution Coefficient, logD

4.634

Water Solubility, LogSw

-4.48

Polar Surface Area

70.951

Acid Dissociation Constant (pKa)

9.61

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G237-0189 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G237-0189 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G237-0189?
Check Price and Availability of G237-0189, 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 G237-0189 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G237-0189
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G237-0189
  • 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 G237-0189 available by request