T802-1179 Screening compound: 2-(2-METHYL-1H-IMIDAZOL-1-YL)-1-{2-[2-(PIPERIDIN-1-YL)ETHYL]PIPERIDIN-1-YL}ETHAN-1-ONE

T802-1179 Screening compound: 2-(2-METHYL-1H-IMIDAZOL-1-YL)-1-{2-[2-(PIPERIDIN-1-YL)ETHYL]PIPERIDIN-1-YL}ETHAN-1-ONE
T802-1179 Screening compound: 2-(2-METHYL-1H-IMIDAZOL-1-YL)-1-{2-[2-(PIPERIDIN-1-YL)ETHYL]PIPERIDIN-1-YL}ETHAN-1-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound T802-1179
2-(2-METHYL-1H-IMIDAZOL-1-YL)-1-{2-[2-(PIPERIDIN-1-YL)ETHYL]PIPERIDIN-1-YL}ETHAN-1-ONE

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

T802-1179

Molecular Formula

C18H30N4O (C18 H30 N4 O)

Compound Name

2-(2-METHYL-1H-IMIDAZOL-1-YL)-1-{2-[2-(PIPERIDIN-1-YL)ETHYL]PIPERIDIN-1-YL}ETHAN-1-ONE

IUPAC name

n/a

SMILES

Cc1nccn1CC(N1C(CCN2CCCCC2)CCCC1)=O

InChI

InChI=1S/C18H30N4O/c1-16-19-9-14-21(16)15-18(23)22-12-6-3-7-17(22)8-13-20-10-4-2-5-11-20/h9,14,17H,2-8,10-13,15H2,1H3/t17-/m1/s1

InChI Key

LUVFCVVDHRACRD-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD27623527

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.46

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.359

Distribution Coefficient, logD

-0.485

Water Solubility, LogSw

-1.31

Polar Surface Area

32.275

Acid Dissociation Constant (pKa)

19.72

Base Dissociation Constant (pKb)

9.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

77.80

T802-1179 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 T802-1179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T802-1179?
Check Price and Availability of T802-1179, 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 T802-1179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T802-1179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T802-1179
  • 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 T802-1179 available by request