F936-0096 Screening compound: 5-chloro-2-methoxy-N-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(pyrrolidin-1-yl)ethyl]benzamide

F936-0096 Screening compound: 5-chloro-2-methoxy-N-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(pyrrolidin-1-yl)ethyl]benzamide
F936-0096 Screening compound: 5-chloro-2-methoxy-N-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(pyrrolidin-1-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F936-0096
5-chloro-2-methoxy-N-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(pyrrolidin-1-yl)ethyl]benzamide

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

F936-0096

Molecular Formula

C24H30ClN3O2 (C24 H30 ClN3 O2)

Compound Name

5-chloro-2-methoxy-N-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(pyrrolidin-1-yl)ethyl]benzamide

IUPAC name

5-chloro-2-methoxy-N-[2-(1-methyl-1234-tetrahydroquinolin-6-yl)-2-(pyrrolidin-1-yl)ethyl]benzamide

SMILES

CN(CCC1)c2c1cc(C(CNC(c(cc(cc1)Cl)c1OC)=O)N1CCCC1)cc2

InChI

InChI=1S/C24H30ClN3O2/c1-27-11-5-6-17-14-18(7-9-21(17)27)22(28-12-3-4-13-28)16-26-24(29)20-15-19(25)8-10-23(20)30-2/h7-10,14-15,22H,3-6,11-13,16H2,1-2H3,(H,26,29)/t22-/m0/s1

InChI Key

TUZPWMPFLQSORD-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD08945777

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.97

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.757

Distribution Coefficient, logD

2.511

Water Solubility, LogSw

-4.43

Polar Surface Area

38.187

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

8.62

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

F936-0096 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with F936-0096 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F936-0096?
Check Price and Availability of F936-0096, 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 F936-0096 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F936-0096
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F936-0096
  • 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 F936-0096 available by request