M563-0032 Screening compound: N-[2-(2-methoxybenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide

M563-0032 Screening compound: N-[2-(2-methoxybenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide
M563-0032 Screening compound: N-[2-(2-methoxybenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M563-0032
N-[2-(2-methoxybenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide

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

M563-0032

Molecular Formula

C25H29N3O4 (C25 H29 N3 O4)

Compound Name

N-[2-(2-methoxybenzoyl)-3-(pyrrolidine-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]propanamide

IUPAC name

N-[2-(2-methoxybenzoyl)-3-(pyrrolidine-1-carbonyl)-1234-tetrahydroisoquinolin-7-yl]propanamide

SMILES

CCC(Nc1cc(CN(C(C2)C(N3CCCC3)=O)C(c(cccc3)c3OC)=O)c2cc1)=O

InChI

InChI=1S/C25H29N3O4/c1-3-23(29)26-19-11-10-17-15-21(25(31)27-12-6-7-13-27)28(16-18(17)14-19)24(30)20-8-4-5-9-22(20)32-2/h4-5,8-11,14,21H,3,6-7,12-13,15-16H2,1-2H3,(H,26,29)/t21-/m0/s1

InChI Key

NSBRAJBDUXRVAR-NRFANRHFSA-N

MDL Number (MFCD)

MFCD27547130

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.959

Distribution Coefficient, logD

2.959

Water Solubility, LogSw

-3.50

Polar Surface Area

64.037

Acid Dissociation Constant (pKa)

12.51

Base Dissociation Constant (pKb)

4.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

M563-0032 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M563-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M563-0032?
Check Price and Availability of M563-0032, 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 M563-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M563-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M563-0032
  • 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 M563-0032 available by request