M291-2367 Screening compound: N-[(3-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide

M291-2367 Screening compound: N-[(3-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide
M291-2367 Screening compound: N-[(3-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M291-2367
N-[(3-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-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

M291-2367

Molecular Formula

C22H21ClFN3O2 (C22 H21 ClFN3 O2)

Compound Name

N-[(3-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide

IUPAC name

N-[(3-chloro-4-fluorophenyl)methyl]-2-methyl-7-(2-methylpropanamido)quinoline-5-carboxamide

SMILES

CC(C)C(Nc1cc2nc(C)ccc2c(C(NCc(cc2)cc(Cl)c2F)=O)c1)=O

InChI

InChI=1S/C22H21ClFN3O2/c1-12(2)21(28)27-15-9-17(16-6-4-13(3)26-20(16)10-15)22(29)25-11-14-5-7-19(24)18(23)8-14/h4-10,12H,11H2,1-3H3,(H,25,29)(H,27,28)

InChI Key

AWTMWESCJYOFBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27535321

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.88

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.008

Distribution Coefficient, logD

5.008

Water Solubility, LogSw

-5.02

Polar Surface Area

56.152

Acid Dissociation Constant (pKa)

10.93

Base Dissociation Constant (pKb)

3.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

M291-2367 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M291-2367 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M291-2367?
Check Price and Availability of M291-2367, 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 M291-2367 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M291-2367
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M291-2367
  • 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 M291-2367 available by request