M670-0227 Screening compound: 1-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidin-1-yl}ethan-1-one

M670-0227 Screening compound: 1-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidin-1-yl}ethan-1-one
M670-0227 Screening compound: 1-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidin-1-yl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M670-0227
1-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidin-1-yl}ethan-1-one

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

M670-0227

Molecular Formula

C17H21N3O (C17 H21 N3 O)

Compound Name

1-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidin-1-yl}ethan-1-one

IUPAC name

1-{4-[1-(4-methylphenyl)-1H-pyrazol-4-yl]piperidin-1-yl}ethan-1-one

SMILES

CC(N(CC1)CCC1c1cn(-c2ccc(C)cc2)nc1)=O

InChI

InChI=1S/C17H21N3O/c1-13-3-5-17(6-4-13)20-12-16(11-18-20)15-7-9-19(10-8-15)14(2)21/h3-6,11-12,15H,7-10H2,1-2H3

InChI Key

NTIRAPUMAQSBKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27550375

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.925

Distribution Coefficient, logD

2.925

Water Solubility, LogSw

-2.81

Polar Surface Area

31.712

Acid Dissociation Constant (pKa)

21.47

Base Dissociation Constant (pKb)

2.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

M670-0227 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
  • Cyclic compounds
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with M670-0227 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M670-0227?
Check Price and Availability of M670-0227, 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 M670-0227 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M670-0227
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M670-0227
  • 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 M670-0227 available by request