T786-0072 Screening compound: 1-[1-(3,5-DIMETHOXYBENZYL)-4-PIPERIDYL]-1-ETHANOL

T786-0072 Screening compound: 1-[1-(3,5-DIMETHOXYBENZYL)-4-PIPERIDYL]-1-ETHANOL
T786-0072 Screening compound: 1-[1-(3,5-DIMETHOXYBENZYL)-4-PIPERIDYL]-1-ETHANOL alternative view

Chemical Structure Depiction of ChemDiv screening compound T786-0072
1-[1-(3,5-DIMETHOXYBENZYL)-4-PIPERIDYL]-1-ETHANOL

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

T786-0072

Molecular Formula

C16H25NO3 (C16 H25 NO3)

Compound Name

1-[1-(3,5-DIMETHOXYBENZYL)-4-PIPERIDYL]-1-ETHANOL

IUPAC name

1-{1-[(35-dimethoxyphenyl)methyl]piperidin-4-yl}ethan-1-ol

SMILES

CC(C1CCN(Cc2cc(OC)cc(OC)c2)CC1)O

InChI

InChI=1S/C16H25NO3/c1-12(18)14-4-6-17(7-5-14)11-13-8-15(19-2)10-16(9-13)20-3/h8-10,12,14,18H,4-7,11H2,1-3H3/t12-/m0/s1

InChI Key

ACAOASYJDPXSIX-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD27623365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.302

Distribution Coefficient, logD

-1.679

Water Solubility, LogSw

-1.97

Polar Surface Area

35.069

Acid Dissociation Constant (pKa)

17.27

Base Dissociation Constant (pKb)

11.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

62.50

T786-0072 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T786-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T786-0072?
Check Price and Availability of T786-0072, 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 T786-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T786-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T786-0072
  • 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 T786-0072 available by request