M406-0988 Screening compound: N-(3-chloro-2-methylphenyl)-5-oxo-1-[3-(phenylcarbamoyl)phenyl]pyrrolidine-3-carboxamide

M406-0988 Screening compound: N-(3-chloro-2-methylphenyl)-5-oxo-1-[3-(phenylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
M406-0988 Screening compound: N-(3-chloro-2-methylphenyl)-5-oxo-1-[3-(phenylcarbamoyl)phenyl]pyrrolidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M406-0988
N-(3-chloro-2-methylphenyl)-5-oxo-1-[3-(phenylcarbamoyl)phenyl]pyrrolidine-3-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

M406-0988

Molecular Formula

C25H22ClN3O3 (C25 H22 ClN3 O3)

Compound Name

N-(3-chloro-2-methylphenyl)-5-oxo-1-[3-(phenylcarbamoyl)phenyl]pyrrolidine-3-carboxamide

IUPAC name

N-(3-chloro-2-methylphenyl)-5-oxo-1-[3-(phenylcarbamoyl)phenyl]pyrrolidine-3-carboxamide

SMILES

Cc(c(NC(C(CC1=O)CN1c1cc(C(Nc2ccccc2)=O)ccc1)=O)ccc1)c1Cl

InChI

InChI=1S/C25H22ClN3O3/c1-16-21(26)11-6-12-22(16)28-25(32)18-14-23(30)29(15-18)20-10-5-7-17(13-20)24(31)27-19-8-3-2-4-9-19/h2-13,18H,14-15H2,1H3,(H,27,31)(H,28,32)/t18-/m0/s1

InChI Key

HJMBIKLOCROLDM-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27540036

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.093

Distribution Coefficient, logD

4.087

Water Solubility, LogSw

-4.32

Polar Surface Area

62.473

Acid Dissociation Constant (pKa)

9.28

Base Dissociation Constant (pKb)

-1.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

M406-0988 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics

References: we are preparing a list of scientific research reports with M406-0988 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M406-0988?
Check Price and Availability of M406-0988, 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 M406-0988 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M406-0988
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M406-0988
  • 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 M406-0988 available by request