8017-0569 Screening compound: 1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-(morpholin-4-yl)ethan-1-one

8017-0569 Screening compound: 1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-(morpholin-4-yl)ethan-1-one
8017-0569 Screening compound: 1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-(morpholin-4-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-0569
1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-(morpholin-4-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

8017-0569

Molecular Formula

C15H20N2O2 (C15 H20 N2 O2)

Compound Name

1-(2-methyl-2,3-dihydro-1H-indol-1-yl)-2-(morpholin-4-yl)ethan-1-one

IUPAC name

1-(2-methyl-23-dihydro-1H-indol-1-yl)-2-(morpholin-4-yl)ethan-1-one

SMILES

CC(C1)N(C(CN2CCOCC2)=O)c2c1cccc2

InChI

InChI=1S/C15H20N2O2/c1-12-10-13-4-2-3-5-14(13)17(12)15(18)11-16-6-8-19-9-7-16/h2-5,12H,6-11H2,1H3/t12-/m0/s1

InChI Key

QEPZJGYXVNLNIJ-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD06013736

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

260.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.236

Distribution Coefficient, logD

1.236

Water Solubility, LogSw

-1.86

Polar Surface Area

26.241

Acid Dissociation Constant (pKa)

23.50

Base Dissociation Constant (pKb)

4.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.30

8017-0569 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8017-0569 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-0569?
Check Price and Availability of 8017-0569, 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 8017-0569 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-0569
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-0569
  • 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 8017-0569 available by request