M305-0188 Screening compound: 3-[1-(4-methylbenzenesulfonyl)piperidin-3-yl]-1-(morpholin-4-yl)propan-1-one

M305-0188 Screening compound: 3-[1-(4-methylbenzenesulfonyl)piperidin-3-yl]-1-(morpholin-4-yl)propan-1-one
M305-0188 Screening compound: 3-[1-(4-methylbenzenesulfonyl)piperidin-3-yl]-1-(morpholin-4-yl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M305-0188
3-[1-(4-methylbenzenesulfonyl)piperidin-3-yl]-1-(morpholin-4-yl)propan-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

M305-0188

Molecular Formula

C19H28N2O4S (C19 H28 N2 O4 S)

Compound Name

3-[1-(4-methylbenzenesulfonyl)piperidin-3-yl]-1-(morpholin-4-yl)propan-1-one

IUPAC name

3-[1-(4-methylbenzenesulfonyl)piperidin-3-yl]-1-(morpholin-4-yl)propan-1-one

SMILES

Cc(cc1)ccc1S(N1CC(CCC(N2CCOCC2)=O)CCC1)(=O)=O

InChI

InChI=1S/C19H28N2O4S/c1-16-4-7-18(8-5-16)26(23,24)21-10-2-3-17(15-21)6-9-19(22)20-11-13-25-14-12-20/h4-5,7-8,17H,2-3,6,9-15H2,1H3/t17-/m1/s1

InChI Key

ISPDXCCTPBFBON-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD28994061

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.038

Distribution Coefficient, logD

2.038

Water Solubility, LogSw

-2.42

Polar Surface Area

55.912

Acid Dissociation Constant (pKa)

24.18

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.20

M305-0188 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

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

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cancer
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with M305-0188 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M305-0188?
Check Price and Availability of M305-0188, 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 M305-0188 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M305-0188
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M305-0188
  • 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 M305-0188 available by request