K072-0025 Screening compound: N'-[(E)-(4,6-dichloro-2H-thiochromen-3-yl)methylidene]pyridine-4-carbohydrazide

K072-0025 Screening compound: N'-[(E)-(4,6-dichloro-2H-thiochromen-3-yl)methylidene]pyridine-4-carbohydrazide
K072-0025 Screening compound: N'-[(E)-(4,6-dichloro-2H-thiochromen-3-yl)methylidene]pyridine-4-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K072-0025
N'-[(E)-(4,6-dichloro-2H-thiochromen-3-yl)methylidene]pyridine-4-carbohydrazide

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

K072-0025

Molecular Formula

C16H11Cl2N3OS (C16 H11 Cl2 N3 OS)

Compound Name

N'-[(E)-(4,6-dichloro-2H-thiochromen-3-yl)methylidene]pyridine-4-carbohydrazide

IUPAC name

N'-[(E)-(46-dichloro-2H-thiochromen-3-yl)methylidene]pyridine-4-carbohydrazide

SMILES

O=C(c1ccncc1)N/N=C/C(CSc(cc1)c2cc1Cl)=C2Cl

InChI

InChI=1S/C16H11Cl2N3OS/c17-12-1-2-14-13(7-12)15(18)11(9-23-14)8-20-21-16(22)10-3-5-19-6-4-10/h1-8H,9H2,(H,21,22)

InChI Key

MTLKKXOLCBWKHY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01248642

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.25

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.068

Distribution Coefficient, logD

3.170

Water Solubility, LogSw

-4.47

Polar Surface Area

44.903

Acid Dissociation Constant (pKa)

6.56

Base Dissociation Constant (pKb)

3.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

K072-0025 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with K072-0025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K072-0025?
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What is the minimum amount of K072-0025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K072-0025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K072-0025
  • 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 K072-0025 available by request