8009-6162 Screening compound: 1-[(2,4-diphenyl-4H-chromen-3-yl)methyl]piperidine

8009-6162 Screening compound: 1-[(2,4-diphenyl-4H-chromen-3-yl)methyl]piperidine
8009-6162 Screening compound: 1-[(2,4-diphenyl-4H-chromen-3-yl)methyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-6162
1-[(2,4-diphenyl-4H-chromen-3-yl)methyl]piperidine

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

8009-6162

Molecular Formula

C27H27NO (C27 H27 NO)

Compound Name

1-[(2,4-diphenyl-4H-chromen-3-yl)methyl]piperidine

IUPAC name

1-[(24-diphenyl-4H-chromen-3-yl)methyl]piperidine

SMILES

C(C(C1c2ccccc2)=C(c2ccccc2)Oc2c1cccc2)N1CCCCC1

InChI

InChI=1S/C27H27NO/c1-4-12-21(13-5-1)26-23-16-8-9-17-25(23)29-27(22-14-6-2-7-15-22)24(26)20-28-18-10-3-11-19-28/h1-2,4-9,12-17,26H,3,10-11,18-20H2/t26-/m1/s1

InChI Key

GWYDJCJGEAPHBM-AREMUKBSSA-N

MDL Number (MFCD)

MFCD00569741

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.52

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.968

Distribution Coefficient, logD

5.968

Water Solubility, LogSw

-6.09

Polar Surface Area

10.592

Acid Dissociation Constant (pKa)

14.48

Base Dissociation Constant (pKb)

4.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.90

8009-6162 in Drug Discovery

Included in Screening Libraries

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 8009-6162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-6162?
Check Price and Availability of 8009-6162, 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 8009-6162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-6162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-6162
  • 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 8009-6162 available by request