K781-2394 Screening compound: N'-(4-chloro-3-nitrobenzoyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyridine-3-carbohydrazide

K781-2394 Screening compound: N'-(4-chloro-3-nitrobenzoyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyridine-3-carbohydrazide
K781-2394 Screening compound: N'-(4-chloro-3-nitrobenzoyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyridine-3-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K781-2394
N'-(4-chloro-3-nitrobenzoyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyridine-3-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

K781-2394

Molecular Formula

C20H14ClN5O6S (C20 H14 ClN5 O6 S)

Compound Name

N'-(4-chloro-3-nitrobenzoyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyridine-3-carbohydrazide

IUPAC name

N'-(4-chloro-3-nitrobenzoyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}pyridine-3-carbohydrazide

SMILES

[O-][N+](c1cccc(CSc(nccc2)c2C(NNC(c(cc2)cc([N+]([O-])=O)c2Cl)=O)=O)c1)=O

InChI

InChI=1S/C20H14ClN5O6S/c21-16-7-6-13(10-17(16)26(31)32)18(27)23-24-19(28)15-5-2-8-22-20(15)33-11-12-3-1-4-14(9-12)25(29)30/h1-10H,11H2,(H,23,27)(H,24,28)

InChI Key

RWPZBGAILPJFAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15094009

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.88

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.457

Distribution Coefficient, logD

3.243

Water Solubility, LogSw

-4.09

Polar Surface Area

126.805

Acid Dissociation Constant (pKa)

7.59

Base Dissociation Constant (pKb)

1.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with K781-2394 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K781-2394?
Check Price and Availability of K781-2394, 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 K781-2394 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K781-2394
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K781-2394
  • 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 K781-2394 available by request