M747-3679 Screening compound: N~3~-{2-[4-(2-methoxyethyl)piperidino]-2-oxoethyl}-N~3~,1,5-trimethyl-1H-pyrazole-3-carboxamide

M747-3679 Screening compound: N~3~-{2-[4-(2-methoxyethyl)piperidino]-2-oxoethyl}-N~3~,1,5-trimethyl-1H-pyrazole-3-carboxamide
M747-3679 Screening compound: N~3~-{2-[4-(2-methoxyethyl)piperidino]-2-oxoethyl}-N~3~,1,5-trimethyl-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M747-3679
N~3~-{2-[4-(2-methoxyethyl)piperidino]-2-oxoethyl}-N~3~,1,5-trimethyl-1H-pyrazole-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

M747-3679

Molecular Formula

C17H28N4O3 (C17 H28 N4 O3)

Compound Name

N~3~-{2-[4-(2-methoxyethyl)piperidino]-2-oxoethyl}-N~3~,1,5-trimethyl-1H-pyrazole-3-carboxamide

IUPAC name

n/a

SMILES

Cc1cc(C(N(C)CC(N2CCC(CCOC)CC2)=O)=O)nn1C

InChI

InChI=1S/C17H28N4O3/c1-13-11-15(18-20(13)3)17(23)19(2)12-16(22)21-8-5-14(6-9-21)7-10-24-4/h11,14H,5-10,12H2,1-4H3

InChI Key

OAXIRHCDDZUOCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030098

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.214

Distribution Coefficient, logD

0.214

Water Solubility, LogSw

-0.58

Polar Surface Area

55.610

Acid Dissociation Constant (pKa)

23.35

Base Dissociation Constant (pKb)

4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

70.60

M747-3679 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M747-3679 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M747-3679?
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What is the minimum amount of M747-3679 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M747-3679
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M747-3679
  • 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 M747-3679 available by request