K786-0126 Screening compound: 1-(1H-1

K786-0126 Screening compound: 1-(1H-1
K786-0126 Screening compound: 1-(1H-1 alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-0126
1-(1H-1

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

K786-0126

Molecular Formula

C21H24N4O2 (C21 H24 N4 O2)

Compound Name

1-(1H-1

IUPAC name

n/a

SMILES

COc1c(CNC(C(CC2)CCN2c2nc(cccc3)c3[nH]2)=O)cccc1

InChI

InChI=1S/C21H24N4O2/c1-27-19-9-5-2-6-16(19)14-22-20(26)15-10-12-25(13-11-15)21-23-17-7-3-4-8-18(17)24-21/h2-9,15H,10-14H2,1H3,(H,22,26)(H,23,24)

InChI Key

LCWNRKLQZUTDDL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03830833

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.45

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.837

Distribution Coefficient, logD

2.806

Water Solubility, LogSw

-3.14

Polar Surface Area

53.953

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

6.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

K786-0126 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
  • Proteases

References: we are preparing a list of scientific research reports with K786-0126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-0126?
Check Price and Availability of K786-0126, 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 K786-0126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-0126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-0126
  • 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 K786-0126 available by request