8017-7141 Screening compound: 1-(4-amino-7-chloro-2-methylquinolin-3-yl)ethan-1-one

8017-7141 Screening compound: 1-(4-amino-7-chloro-2-methylquinolin-3-yl)ethan-1-one
8017-7141 Screening compound: 1-(4-amino-7-chloro-2-methylquinolin-3-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-7141
1-(4-amino-7-chloro-2-methylquinolin-3-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

8017-7141

Molecular Formula

C12H11ClN2O (C12 H11 ClN2 O)

Compound Name

1-(4-amino-7-chloro-2-methylquinolin-3-yl)ethan-1-one

IUPAC name

1-(4-amino-7-chloro-2-methylquinolin-3-yl)ethan-1-one

SMILES

CC(c1c(C)nc(cc(cc2)Cl)c2c1N)=O

InChI

InChI=1S/C12H11ClN2O/c1-6-11(7(2)16)12(14)9-4-3-8(13)5-10(9)15-6/h3-5H,1-2H3,(H2,14,15)

InChI Key

LMYIWLSXMMTSFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05839729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.68

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.706

Distribution Coefficient, logD

2.706

Water Solubility, LogSw

-3.85

Polar Surface Area

42.359

Acid Dissociation Constant (pKa)

15.15

Base Dissociation Constant (pKb)

3.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

8017-7141 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

GABA Library (7115 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Eye
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8017-7141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-7141?
Check Price and Availability of 8017-7141, 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 8017-7141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-7141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-7141
  • 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 8017-7141 available by request