C200-6932 Screening compound: 1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carbothioamide

C200-6932 Screening compound: 1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carbothioamide
C200-6932 Screening compound: 1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carbothioamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-6932
1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carbothioamide

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

C200-6932

Molecular Formula

C11H12N4OS (C11 H12 N4 OS)

Compound Name

1-(3-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carbothioamide

IUPAC name

1-(3-methoxyphenyl)-5-methyl-1H-123-triazole-4-carbothioamide

SMILES

Cc1c(C(N)=S)nnn1-c1cc(OC)ccc1

InChI

InChI=1S/C11H12N4OS/c1-7-10(11(12)17)13-14-15(7)8-4-3-5-9(6-8)16-2/h3-6H,1-2H3,(H2,12,17)

InChI Key

PUARBIQKCIUPPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11994956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.446

Distribution Coefficient, logD

1.446

Water Solubility, LogSw

-2.14

Polar Surface Area

54.078

Acid Dissociation Constant (pKa)

13.75

Base Dissociation Constant (pKb)

2.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

C200-6932 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C200-6932 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-6932?
Check Price and Availability of C200-6932, 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 C200-6932 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-6932
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-6932
  • 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 C200-6932 available by request