M565-0141 Screening compound: N~5~-benzyl-N~5~-methyl-5-isoquinolinecarboxamide

M565-0141 Screening compound: N~5~-benzyl-N~5~-methyl-5-isoquinolinecarboxamide
M565-0141 Screening compound: N~5~-benzyl-N~5~-methyl-5-isoquinolinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M565-0141
N~5~-benzyl-N~5~-methyl-5-isoquinolinecarboxamide

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

M565-0141

Molecular Formula

C18H16N2O (C18 H16 N2 O)

Compound Name

N~5~-benzyl-N~5~-methyl-5-isoquinolinecarboxamide

IUPAC name

N-benzyl-N-methylisoquinoline-5-carboxamide

SMILES

CN(Cc1ccccc1)C(c1cccc2cnccc12)=O

InChI

InChI=1S/C18H16N2O/c1-20(13-14-6-3-2-4-7-14)18(21)17-9-5-8-15-12-19-11-10-16(15)17/h2-12H,13H2,1H3

InChI Key

UCBUGAKYKKVSEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27547296

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.203

Distribution Coefficient, logD

3.203

Water Solubility, LogSw

-3.25

Polar Surface Area

25.635

Acid Dissociation Constant (pKa)

27.60

Base Dissociation Constant (pKb)

3.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.11

M565-0141 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Aging Library (44940 compounds)

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

Cardiovascular Library (22201 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Others

References: we are preparing a list of scientific research reports with M565-0141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M565-0141?
Check Price and Availability of M565-0141, 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 M565-0141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M565-0141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M565-0141
  • 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 M565-0141 available by request