C200-1429 Screening compound: 3-(2-chloropyridin-3-yl)-1-(4-methylbenzoyl)thiourea

C200-1429 Screening compound: 3-(2-chloropyridin-3-yl)-1-(4-methylbenzoyl)thiourea
C200-1429 Screening compound: 3-(2-chloropyridin-3-yl)-1-(4-methylbenzoyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-1429
3-(2-chloropyridin-3-yl)-1-(4-methylbenzoyl)thiourea

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

C200-1429

Molecular Formula

C14H12ClN3OS (C14 H12 ClN3 OS)

Compound Name

3-(2-chloropyridin-3-yl)-1-(4-methylbenzoyl)thiourea

IUPAC name

3-(2-chloropyridin-3-yl)-1-(4-methylbenzoyl)thiourea

SMILES

Cc(cc1)ccc1C(NC(Nc1cccnc1Cl)=S)=O

InChI

InChI=1S/C14H12ClN3OS/c1-9-4-6-10(7-5-9)13(19)18-14(20)17-11-3-2-8-16-12(11)15/h2-8H,1H3,(H2,17,18,19,20)

InChI Key

ZXIKFSUOEMZRFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04445169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.79

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.306

Distribution Coefficient, logD

3.290

Water Solubility, LogSw

-3.77

Polar Surface Area

42.227

Acid Dissociation Constant (pKa)

8.83

Base Dissociation Constant (pKb)

0.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

C200-1429 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 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 C200-1429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-1429?
Check Price and Availability of C200-1429, 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 C200-1429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-1429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-1429
  • 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 C200-1429 available by request