8012-9957 Screening compound: 8-methoxy-2,2,4-trimethyl-1,2-dihydroquinoline

8012-9957 Screening compound: 8-methoxy-2,2,4-trimethyl-1,2-dihydroquinoline
8012-9957 Screening compound: 8-methoxy-2,2,4-trimethyl-1,2-dihydroquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8012-9957
8-methoxy-2,2,4-trimethyl-1,2-dihydroquinoline

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

8012-9957

Molecular Formula

C13H17NO (C13 H17 NO)

Compound Name

8-methoxy-2,2,4-trimethyl-1,2-dihydroquinoline

IUPAC name

8-methoxy-224-trimethyl-12-dihydroquinoline

SMILES

CC(C)(C=C(C)c1ccc2)Nc1c2OC

InChI

InChI=1S/C13H17NO/c1-9-8-13(2,3)14-12-10(9)6-5-7-11(12)15-4/h5-8,14H,1-4H3

InChI Key

KRUCENDXMOILSL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03408197

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

203.28

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.944

Distribution Coefficient, logD

2.944

Water Solubility, LogSw

-3.59

Polar Surface Area

16.816

Acid Dissociation Constant (pKa)

16.93

Base Dissociation Constant (pKb)

3.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.46

8012-9957 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8012-9957 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8012-9957?
Check Price and Availability of 8012-9957, 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 8012-9957 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8012-9957
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8012-9957
  • 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 8012-9957 available by request