F936-0460 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(morpholin-4-yl)ethyl]ethanediamide

F936-0460 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(morpholin-4-yl)ethyl]ethanediamide
F936-0460 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(morpholin-4-yl)ethyl]ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F936-0460
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(morpholin-4-yl)ethyl]ethanediamide

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

F936-0460

Molecular Formula

C26H32N4O5 (C26 H32 N4 O5)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-N'-[2-(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)-2-(morpholin-4-yl)ethyl]ethanediamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-N'-[2-(1-methyl-1234-tetrahydroquinolin-6-yl)-2-(morpholin-4-yl)ethyl]ethanediamide

SMILES

CN(CCC1)c2c1cc(C(CNC(C(NCc(cc1)cc3c1OCO3)=O)=O)N1CCOCC1)cc2

InChI

InChI=1S/C26H32N4O5/c1-29-8-2-3-19-14-20(5-6-21(19)29)22(30-9-11-33-12-10-30)16-28-26(32)25(31)27-15-18-4-7-23-24(13-18)35-17-34-23/h4-7,13-14,22H,2-3,8-12,15-17H2,1H3,(H,27,31)(H,28,32)/t22-/m0/s1

InChI Key

BNEBGSLPXPWOGK-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD08946265

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.401

Distribution Coefficient, logD

1.363

Water Solubility, LogSw

-2.21

Polar Surface Area

79.899

Acid Dissociation Constant (pKa)

8.94

Base Dissociation Constant (pKb)

6.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

F936-0460 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Lipid Metabolism Library (9174 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with F936-0460 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F936-0460?
Check Price and Availability of F936-0460, 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 F936-0460 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F936-0460
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F936-0460
  • 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 F936-0460 available by request