8012-5826 Screening compound: (4aR,8aR)octahydro-4(1H)-quinolinone

8012-5826 Screening compound: (4aR,8aR)octahydro-4(1H)-quinolinone
8012-5826 Screening compound: (4aR,8aR)octahydro-4(1H)-quinolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-5826
(4aR,8aR)octahydro-4(1H)-quinolinone

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

8012-5826

Molecular Formula

C9H15NO (C9 H15 NO)

Compound Name

(4aR,8aR)octahydro-4(1H)-quinolinone

IUPAC name

(4aR8aR)-decahydroquinolin-4-one

SMILES

O=C1[C@@H](CCCC2)[C@H]2NCC1

InChI

InChI=1S/C9H15NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h7-8,10H,1-6H2/t7-,8-/m0/s1

InChI Key

VZTBFFGJFFYFRT-YUMQZZPRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

153.22

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

0.696

Distribution Coefficient, logD

-0.036

Water Solubility, LogSw

-1.43

Polar Surface Area

25.767

Acid Dissociation Constant (pKa)

20.64

Base Dissociation Constant (pKb)

8.04

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

88.89

8012-5826 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8012-5826 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-5826?
Check Price and Availability of 8012-5826, 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 8012-5826 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-5826
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-5826
  • 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 8012-5826 available by request