S761-0299 Screening compound: 1-[1-benzyl-2-(methoxymethyl)piperidine-3-carbonyl]-4-phenylpiperazine

S761-0299 Screening compound: 1-[1-benzyl-2-(methoxymethyl)piperidine-3-carbonyl]-4-phenylpiperazine
S761-0299 Screening compound: 1-[1-benzyl-2-(methoxymethyl)piperidine-3-carbonyl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound S761-0299
1-[1-benzyl-2-(methoxymethyl)piperidine-3-carbonyl]-4-phenylpiperazine

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

S761-0299

Molecular Formula

C25H33N3O2 (C25 H33 N3 O2)

Compound Name

1-[1-benzyl-2-(methoxymethyl)piperidine-3-carbonyl]-4-phenylpiperazine

IUPAC name

1-[(2S3R)-1-benzyl-2-(methoxymethyl)piperidine-3-carbonyl]-4-phenylpiperazine

SMILES

COC[C@@H]1N(Cc2ccccc2)CCC[C@@H]1C(N(CC1)CCN1c1ccccc1)=O

InChI

InChI=1S/C25H33N3O2/c1-30-20-24-23(13-8-14-28(24)19-21-9-4-2-5-10-21)25(29)27-17-15-26(16-18-27)22-11-6-3-7-12-22/h2-7,9-12,23-24H,8,13-20H2,1H3/t23-,24-/m0/s1

InChI Key

BOVBTGKRHXPYDS-ZEQRLZLVSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.105

Distribution Coefficient, logD

2.830

Water Solubility, LogSw

-3.14

Polar Surface Area

31.939

Acid Dissociation Constant (pKa)

23.36

Base Dissociation Constant (pKb)

7.35

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

48.00

S761-0299 in Drug Discovery

Included in Screening Libraries

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 S761-0299 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S761-0299?
Check Price and Availability of S761-0299, 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 S761-0299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S761-0299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S761-0299
  • 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 S761-0299 available by request