K256-0205 Screening compound: methyl 2-({[(pyridin-4-yl)formohydrazido]methanethioyl}amino)pyridine-3-carboxylate

K256-0205 Screening compound: methyl 2-({[(pyridin-4-yl)formohydrazido]methanethioyl}amino)pyridine-3-carboxylate
K256-0205 Screening compound: methyl 2-({[(pyridin-4-yl)formohydrazido]methanethioyl}amino)pyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K256-0205
methyl 2-({[(pyridin-4-yl)formohydrazido]methanethioyl}amino)pyridine-3-carboxylate

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

K256-0205

Molecular Formula

C14H13N5O3S (C14 H13 N5 O3 S)

Compound Name

methyl 2-({[(pyridin-4-yl)formohydrazido]methanethioyl}amino)pyridine-3-carboxylate

IUPAC name

methyl 2-({[(pyridin-4-yl)formohydrazido]methanethioyl}amino)pyridine-3-carboxylate

SMILES

COC(c1cccnc1NC(NNC(c1ccncc1)=O)=S)=O

InChI

InChI=1S/C14H13N5O3S/c1-22-13(21)10-3-2-6-16-11(10)17-14(23)19-18-12(20)9-4-7-15-8-5-9/h2-8H,1H3,(H,18,20)(H2,16,17,19,23)

InChI Key

KMCFVSVQNHIJJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03830112

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.36

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.790

Distribution Coefficient, logD

-0.195

Water Solubility, LogSw

-1.92

Polar Surface Area

87.456

Acid Dissociation Constant (pKa)

6.46

Base Dissociation Constant (pKb)

3.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

K256-0205 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with K256-0205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K256-0205?
Check Price and Availability of K256-0205, 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 K256-0205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K256-0205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K256-0205
  • 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 K256-0205 available by request