C270-0820 Screening compound: 1-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)urea

C270-0820 Screening compound: 1-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)urea
C270-0820 Screening compound: 1-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C270-0820
1-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)urea

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

C270-0820

Molecular Formula

C25H32FN3O (C25 H32 FN3 O)

Compound Name

1-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)urea

IUPAC name

1-({1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl}methyl)-3-(5678-tetrahydronaphthalen-1-yl)urea

SMILES

O=C(NCC1CCN(CCc(cc2)ccc2F)CC1)Nc1c(CCCC2)c2ccc1

InChI

InChI=1S/C25H32FN3O/c26-22-10-8-19(9-11-22)12-15-29-16-13-20(14-17-29)18-27-25(30)28-24-7-3-5-21-4-1-2-6-23(21)24/h3,5,7-11,20H,1-2,4,6,12-18H2,(H2,27,28,30)

InChI Key

RBRVGHIDDPSWGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14740002

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.55

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.126

Distribution Coefficient, logD

2.645

Water Solubility, LogSw

-5.31

Polar Surface Area

36.797

Acid Dissociation Constant (pKa)

14.23

Base Dissociation Constant (pKb)

9.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

C270-0820 in Drug Discovery

Included in Screening Libraries

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C270-0820 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C270-0820?
Check Price and Availability of C270-0820, 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 C270-0820 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C270-0820
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C270-0820
  • 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 C270-0820 available by request