M980-0160 Screening compound: 1-(2-methyl-1,3-benzoxazol-5-yl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-2-one

M980-0160 Screening compound: 1-(2-methyl-1,3-benzoxazol-5-yl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-2-one
M980-0160 Screening compound: 1-(2-methyl-1,3-benzoxazol-5-yl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M980-0160
1-(2-methyl-1,3-benzoxazol-5-yl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-2-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

M980-0160

Molecular Formula

C24H26N4O3 (C24 H26 N4 O3)

Compound Name

1-(2-methyl-1,3-benzoxazol-5-yl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-2-one

IUPAC name

1-(2-methyl-13-benzoxazol-5-yl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-2-one

SMILES

Cc1nc(cc(cc2)N(CC(C3)C(N(CC4)CCN4c4c(C)cccc4)=O)C3=O)c2o1

InChI

InChI=1S/C24H26N4O3/c1-16-5-3-4-6-21(16)26-9-11-27(12-10-26)24(30)18-13-23(29)28(15-18)19-7-8-22-20(14-19)25-17(2)31-22/h3-8,14,18H,9-13,15H2,1-2H3/t18-/m1/s1

InChI Key

CFRXDGBRHXKSTH-GOSISDBHSA-N

MDL Number (MFCD)

MFCD27558506

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.175

Distribution Coefficient, logD

3.175

Water Solubility, LogSw

-3.30

Polar Surface Area

52.906

Acid Dissociation Constant (pKa)

12.84

Base Dissociation Constant (pKb)

4.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.50

M980-0160 in Drug Discovery

Included in Screening Libraries

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

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with M980-0160 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M980-0160?
Check Price and Availability of M980-0160, 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 M980-0160 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M980-0160
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M980-0160
  • 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 M980-0160 available by request