K216-1340 Screening compound: 8-[2,3-bis(3-methylphenyl)quinoxaline-6-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

K216-1340 Screening compound: 8-[2,3-bis(3-methylphenyl)quinoxaline-6-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane
K216-1340 Screening compound: 8-[2,3-bis(3-methylphenyl)quinoxaline-6-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane alternative view

Chemical Structure Depiction of ChemDiv screening compound K216-1340
8-[2,3-bis(3-methylphenyl)quinoxaline-6-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

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

K216-1340

Molecular Formula

C30H29N3O3 (C30 H29 N3 O3)

Compound Name

8-[2,3-bis(3-methylphenyl)quinoxaline-6-carbonyl]-1,4-dioxa-8-azaspiro[4.5]decane

IUPAC name

8-[23-bis(3-methylphenyl)quinoxaline-6-carbonyl]-14-dioxa-8-azaspiro[4.5]decane

SMILES

Cc1cccc(-c2c(-c3cc(C)ccc3)nc(cc(cc3)C(N(CC4)CCC44OCCO4)=O)c3n2)c1

InChI

InChI=1S/C30H29N3O3/c1-20-5-3-7-22(17-20)27-28(23-8-4-6-21(2)18-23)32-26-19-24(9-10-25(26)31-27)29(34)33-13-11-30(12-14-33)35-15-16-36-30/h3-10,17-19H,11-16H2,1-2H3

InChI Key

RKXHSZMOVRQGCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15081399

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.784

Distribution Coefficient, logD

4.783

Water Solubility, LogSw

-4.64

Polar Surface Area

49.254

Acid Dissociation Constant (pKa)

27.30

Base Dissociation Constant (pKb)

4.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

K216-1340 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS targets activity set (6557 compounds)

Regenerative Medicine Focused Library (23016 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with K216-1340 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K216-1340?
Check Price and Availability of K216-1340, 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 K216-1340 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K216-1340
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K216-1340
  • 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 K216-1340 available by request