8008-9180 Screening compound: 1,2,6-trimethylpiperidin-4-yl 3-(4-methoxyphenyl)-2-phenylpropanoate

8008-9180 Screening compound: 1,2,6-trimethylpiperidin-4-yl 3-(4-methoxyphenyl)-2-phenylpropanoate
8008-9180 Screening compound: 1,2,6-trimethylpiperidin-4-yl 3-(4-methoxyphenyl)-2-phenylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-9180
1,2,6-trimethylpiperidin-4-yl 3-(4-methoxyphenyl)-2-phenylpropanoate

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

8008-9180

Molecular Formula

C24H31NO3 (C24 H31 NO3)

Compound Name

1,2,6-trimethylpiperidin-4-yl 3-(4-methoxyphenyl)-2-phenylpropanoate

IUPAC name

126-trimethylpiperidin-4-yl 3-(4-methoxyphenyl)-2-phenylpropanoate

SMILES

CC(C1)N(C)C(C)CC1OC(C(Cc(cc1)ccc1OC)c1ccccc1)=O

InChI

InChI=1S/C24H31NO3/c1-17-14-22(15-18(2)25(17)3)28-24(26)23(20-8-6-5-7-9-20)16-19-10-12-21(27-4)13-11-19/h5-13,17-18,22-23H,14-16H2,1-4H3

InChI Key

GNHPJGJHBNDLTI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460348

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.696

Distribution Coefficient, logD

1.077

Water Solubility, LogSw

-4.36

Polar Surface Area

29.727

Acid Dissociation Constant (pKa)

17.72

Base Dissociation Constant (pKb)

11.02

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

45.80

8008-9180 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

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

CNS BBB Library (22607 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
  • Nervous system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • Kinases
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 8008-9180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-9180?
Check Price and Availability of 8008-9180, 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 8008-9180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-9180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-9180
  • 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 8008-9180 available by request