M070-1154 Screening compound: 4-cyano-N-[2-(propan-2-ylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide

M070-1154 Screening compound: 4-cyano-N-[2-(propan-2-ylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide
M070-1154 Screening compound: 4-cyano-N-[2-(propan-2-ylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M070-1154
4-cyano-N-[2-(propan-2-ylsulfanyl)-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

M070-1154

Molecular Formula

C17H15N3O2S3 (C17 H15 N3 O2 S3)

Compound Name

4-cyano-N-[2-(propan-2-ylsulfanyl)-1,3-benzothiazol-6-yl]benzene-1-sulfonamide

IUPAC name

4-cyano-N-[2-(propan-2-ylsulfanyl)-13-benzothiazol-6-yl]benzene-1-sulfonamide

SMILES

CC(C)Sc1nc(ccc(NS(c(cc2)ccc2C#N)(=O)=O)c2)c2s1

InChI

InChI=1S/C17H15N3O2S3/c1-11(2)23-17-19-15-8-5-13(9-16(15)24-17)20-25(21,22)14-6-3-12(10-18)4-7-14/h3-9,11,20H,1-2H3

InChI Key

CWXLINKRBJPFIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27495551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.685

Distribution Coefficient, logD

4.555

Water Solubility, LogSw

-4.52

Polar Surface Area

67.026

Acid Dissociation Constant (pKa)

7.86

Base Dissociation Constant (pKb)

1.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with M070-1154 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M070-1154?
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What is the minimum amount of M070-1154 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M070-1154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M070-1154
  • 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 M070-1154 available by request