C200-3120 Screening compound: 1-(3-chloro-2-methylphenyl)-5-methyl-4-(4-methylbenzenesulfonyl)-1H-1,2,3-triazole

C200-3120 Screening compound: 1-(3-chloro-2-methylphenyl)-5-methyl-4-(4-methylbenzenesulfonyl)-1H-1,2,3-triazole
C200-3120 Screening compound: 1-(3-chloro-2-methylphenyl)-5-methyl-4-(4-methylbenzenesulfonyl)-1H-1,2,3-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-3120
1-(3-chloro-2-methylphenyl)-5-methyl-4-(4-methylbenzenesulfonyl)-1H-1,2,3-triazole

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

C200-3120

Molecular Formula

C17H16ClN3O2S (C17 H16 ClN3 O2 S)

Compound Name

1-(3-chloro-2-methylphenyl)-5-methyl-4-(4-methylbenzenesulfonyl)-1H-1,2,3-triazole

IUPAC name

1-(3-chloro-2-methylphenyl)-5-methyl-4-(4-methylbenzenesulfonyl)-1H-123-triazole

SMILES

Cc(n(-c1cccc(Cl)c1C)nn1)c1S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C17H16ClN3O2S/c1-11-7-9-14(10-8-11)24(22,23)17-13(3)21(20-19-17)16-6-4-5-15(18)12(16)2/h4-10H,1-3H3

InChI Key

BKCSFULXIUYCLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07654618

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.85

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.336

Distribution Coefficient, logD

4.336

Water Solubility, LogSw

-4.44

Polar Surface Area

56.056

Acid Dissociation Constant (pKa)

21.19

Base Dissociation Constant (pKb)

-3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

C200-3120 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

?ysteine Targeted Covalent Library (39471 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 C200-3120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-3120?
Check Price and Availability of C200-3120, 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 C200-3120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-3120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-3120
  • 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 C200-3120 available by request