M346-0252 Screening compound: 2,5-dimethyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}benzene-1-sulfonamide

M346-0252 Screening compound: 2,5-dimethyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}benzene-1-sulfonamide
M346-0252 Screening compound: 2,5-dimethyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M346-0252
2,5-dimethyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}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

M346-0252

Molecular Formula

C17H18N4O2S (C17 H18 N4 O2 S)

Compound Name

2,5-dimethyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}benzene-1-sulfonamide

IUPAC name

25-dimethyl-N-{4-[(1H-124-triazol-1-yl)methyl]phenyl}benzene-1-sulfonamide

SMILES

Cc1cc(S(Nc2ccc(Cn3ncnc3)cc2)(=O)=O)c(C)cc1

InChI

InChI=1S/C17H18N4O2S/c1-13-3-4-14(2)17(9-13)24(22,23)20-16-7-5-15(6-8-16)10-21-12-18-11-19-21/h3-9,11-12,20H,10H2,1-2H3

InChI Key

HJBIUSDJUVPGCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08722225

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.577

Distribution Coefficient, logD

2.476

Water Solubility, LogSw

-2.71

Polar Surface Area

65.865

Acid Dissociation Constant (pKa)

7.99

Base Dissociation Constant (pKb)

1.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

M346-0252 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M346-0252 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M346-0252?
Check Price and Availability of M346-0252, 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 M346-0252 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M346-0252
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M346-0252
  • 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 M346-0252 available by request