8011-7260 Screening compound: 6-hexyl-10-nitro-13,13-diphenyl-11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine

8011-7260 Screening compound: 6-hexyl-10-nitro-13,13-diphenyl-11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine
8011-7260 Screening compound: 6-hexyl-10-nitro-13,13-diphenyl-11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-7260
6-hexyl-10-nitro-13,13-diphenyl-11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine

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

8011-7260

Molecular Formula

C33H32N2O4 (C33 H32 N2 O4)

Compound Name

6-hexyl-10-nitro-13,13-diphenyl-11bH,13H-[1,3]benzoxazino[3,4-a][3,1]benzoxazine

IUPAC name

18-hexyl-13-nitro-88-diphenyl-917-dioxa-1-azatetracyclo[8.8.0.0^{27}.0^{1116}]octadeca-2(7)35111315-hexaene

SMILES

CCCCCCC(N(C1OC2(c3ccccc3)c3ccccc3)c3c2cccc3)Oc(cc2)c1cc2[N+]([O-])=O

InChI

InChI=1S/C33H32N2O4/c1-2-3-4-11-20-31-34-29-19-13-12-18-28(29)33(24-14-7-5-8-15-24,25-16-9-6-10-17-25)39-32(34)27-23-26(35(36)37)21-22-30(27)38-31/h5-10,12-19,21-23,31-32H,2-4,11,20H2,1H3

InChI Key

JUEZFFDZINZSQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02933099

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

9.460

Distribution Coefficient, logD

9.460

Water Solubility, LogSw

-5.89

Polar Surface Area

49.272

Acid Dissociation Constant (pKa)

18.04

Base Dissociation Constant (pKb)

-1.71

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

27.30

8011-7260 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Cancer
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 8011-7260 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-7260?
Check Price and Availability of 8011-7260, 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 8011-7260 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-7260
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-7260
  • 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 8011-7260 available by request