M070-0117 Screening compound: 3,5-dimethyl-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide

M070-0117 Screening compound: 3,5-dimethyl-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
M070-0117 Screening compound: 3,5-dimethyl-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M070-0117
3,5-dimethyl-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-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

M070-0117

Molecular Formula

C16H16N2O2S3 (C16 H16 N2 O2 S3)

Compound Name

3,5-dimethyl-N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide

IUPAC name

35-dimethyl-N-[2-(methylsulfanyl)-13-benzothiazol-6-yl]benzene-1-sulfonamide

SMILES

Cc1cc(S(Nc(cc2)cc3c2nc(SC)s3)(=O)=O)cc(C)c1

InChI

InChI=1S/C16H16N2O2S3/c1-10-6-11(2)8-13(7-10)23(19,20)18-12-4-5-14-15(9-12)22-16(17-14)21-3/h4-9,18H,1-3H3

InChI Key

FBNTZLSYMSCZRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27495453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.946

Distribution Coefficient, logD

4.816

Water Solubility, LogSw

-4.76

Polar Surface Area

49.969

Acid Dissociation Constant (pKa)

7.86

Base Dissociation Constant (pKb)

1.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

M070-0117 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with M070-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M070-0117?
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What is the minimum amount of M070-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M070-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M070-0117
  • 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 M070-0117 available by request