G237-0114 Screening compound: 2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-phenylethyl)acetamide

G237-0114 Screening compound: 2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-phenylethyl)acetamide
G237-0114 Screening compound: 2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G237-0114
2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-phenylethyl)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

G237-0114

Molecular Formula

C25H25N3O3S2 (C25 H25 N3 O3 S2)

Compound Name

2-(N-benzyl2-methyl-1,3-benzothiazole-6-sulfonamido)-N-(2-phenylethyl)acetamide

IUPAC name

2-(N-benzyl2-methyl-13-benzothiazole-6-sulfonamido)-N-(2-phenylethyl)acetamide

SMILES

Cc1nc(ccc(S(N(CC(NCCc2ccccc2)=O)Cc2ccccc2)(=O)=O)c2)c2s1

InChI

InChI=1S/C25H25N3O3S2/c1-19-27-23-13-12-22(16-24(23)32-19)33(30,31)28(17-21-10-6-3-7-11-21)18-25(29)26-15-14-20-8-4-2-5-9-20/h2-13,16H,14-15,17-18H2,1H3,(H,26,29)

InChI Key

XOZKDTUJLIEFFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14989094

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.62

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

4.152

Distribution Coefficient, logD

4.152

Water Solubility, LogSw

-4.26

Polar Surface Area

65.182

Acid Dissociation Constant (pKa)

12.74

Base Dissociation Constant (pKb)

-1.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G237-0114 in Drug Discovery

Included in Screening Libraries

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 G237-0114 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G237-0114?
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What is the minimum amount of G237-0114 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G237-0114
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G237-0114
  • 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 G237-0114 available by request