T786-0752 Screening compound: {1-[(5-METHYLFURAN-2-YL)METHYL]PIPERIDIN-4-YL}(PYRIDIN-2-YL)METHANOL

T786-0752 Screening compound: {1-[(5-METHYLFURAN-2-YL)METHYL]PIPERIDIN-4-YL}(PYRIDIN-2-YL)METHANOL
T786-0752 Screening compound: {1-[(5-METHYLFURAN-2-YL)METHYL]PIPERIDIN-4-YL}(PYRIDIN-2-YL)METHANOL alternative view

Chemical Structure Depiction of ChemDiv screening compound T786-0752
{1-[(5-METHYLFURAN-2-YL)METHYL]PIPERIDIN-4-YL}(PYRIDIN-2-YL)METHANOL

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

T786-0752

Molecular Formula

C17H22N2O2 (C17 H22 N2 O2)

Compound Name

{1-[(5-METHYLFURAN-2-YL)METHYL]PIPERIDIN-4-YL}(PYRIDIN-2-YL)METHANOL

IUPAC name

n/a

SMILES

Cc1ccc(CN(CC2)CCC2C(c2ncccc2)O)o1

InChI

InChI=1S/C17H22N2O2/c1-13-5-6-15(21-13)12-19-10-7-14(8-11-19)17(20)16-4-2-3-9-18-16/h2-6,9,14,17,20H,7-8,10-12H2,1H3/t17-/m0/s1

InChI Key

YNAXOZKDAAACJO-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD27623380

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.945

Distribution Coefficient, logD

0.203

Water Solubility, LogSw

-1.84

Polar Surface Area

35.695

Acid Dissociation Constant (pKa)

15.38

Base Dissociation Constant (pKb)

9.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.10

T786-0752 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T786-0752 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T786-0752?
Check Price and Availability of T786-0752, 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 T786-0752 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T786-0752
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T786-0752
  • 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 T786-0752 available by request