M291-1243 Screening compound: N-benzyl-7-acetamido-N,2-dimethylquinoline-5-carboxamide

M291-1243 Screening compound: N-benzyl-7-acetamido-N,2-dimethylquinoline-5-carboxamide
M291-1243 Screening compound: N-benzyl-7-acetamido-N,2-dimethylquinoline-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M291-1243
N-benzyl-7-acetamido-N,2-dimethylquinoline-5-carboxamide

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

M291-1243

Molecular Formula

C21H21N3O2 (C21 H21 N3 O2)

Compound Name

N-benzyl-7-acetamido-N,2-dimethylquinoline-5-carboxamide

IUPAC name

N-benzyl-7-acetamido-N2-dimethylquinoline-5-carboxamide

SMILES

CC(Nc1cc2nc(C)ccc2c(C(N(C)Cc2ccccc2)=O)c1)=O

InChI

InChI=1S/C21H21N3O2/c1-14-9-10-18-19(11-17(23-15(2)25)12-20(18)22-14)21(26)24(3)13-16-7-5-4-6-8-16/h4-12H,13H2,1-3H3,(H,23,25)

InChI Key

JVQDWIODEISGAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27535293

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.42

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.498

Distribution Coefficient, logD

3.498

Water Solubility, LogSw

-3.78

Polar Surface Area

47.788

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

M291-1243 in Drug Discovery

Included in Screening Libraries

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

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with M291-1243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M291-1243?
Check Price and Availability of M291-1243, 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 M291-1243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M291-1243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M291-1243
  • 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 M291-1243 available by request