M952-0952 Screening compound: 1-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]sulfonyl}-4-(propan-2-yl)piperazine

M952-0952 Screening compound: 1-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]sulfonyl}-4-(propan-2-yl)piperazine
M952-0952 Screening compound: 1-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]sulfonyl}-4-(propan-2-yl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound M952-0952
1-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]sulfonyl}-4-(propan-2-yl)piperazine

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

M952-0952

Molecular Formula

C19H29N5O3S (C19 H29 N5 O3 S)

Compound Name

1-{[4-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]sulfonyl}-4-(propan-2-yl)piperazine

IUPAC name

1-{[4-(5-cyclobutyl-134-oxadiazol-2-yl)-25-dimethyl-1H-pyrrol-3-yl]sulfonyl}-4-(propan-2-yl)piperazine

SMILES

CC(C)N(CC1)CCN1S(c1c(C)[nH]c(C)c1-c1nnc(C2CCC2)o1)(=O)=O

InChI

InChI=1S/C19H29N5O3S/c1-12(2)23-8-10-24(11-9-23)28(25,26)17-14(4)20-13(3)16(17)19-22-21-18(27-19)15-6-5-7-15/h12,15,20H,5-11H2,1-4H3

InChI Key

TXUSTGPBOFXJAW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27557363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.722

Distribution Coefficient, logD

1.543

Water Solubility, LogSw

-2.20

Polar Surface Area

77.369

Acid Dissociation Constant (pKa)

16.20

Base Dissociation Constant (pKb)

7.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.40

M952-0952 in Drug Discovery

Included in Screening Libraries

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Epigenetic
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases

References: we are preparing a list of scientific research reports with M952-0952 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M952-0952?
Check Price and Availability of M952-0952, 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 M952-0952 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M952-0952
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M952-0952
  • 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 M952-0952 available by request