S632-5330 Screening compound: 5-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidin-1-yl]-5-oxopentanoic acid

S632-5330 Screening compound: 5-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidin-1-yl]-5-oxopentanoic acid
S632-5330 Screening compound: 5-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidin-1-yl]-5-oxopentanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound S632-5330
5-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidin-1-yl]-5-oxopentanoic acid

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

S632-5330

Molecular Formula

C15H26N2O5S (C15 H26 N2 O5 S)

Compound Name

5-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidin-1-yl]-5-oxopentanoic acid

IUPAC name

5-[3-(1-methanesulfonylpiperidin-4-yl)pyrrolidin-1-yl]-5-oxopentanoic acid

SMILES

CS(N(CC1)CCC1C(CC1)CN1C(CCCC(O)=O)=O)(=O)=O

InChI

InChI=1S/C15H26N2O5S/c1-23(21,22)17-9-6-12(7-10-17)13-5-8-16(11-13)14(18)3-2-4-15(19)20/h12-13H,2-11H2,1H3,(H,19,20)/t13-/m0/s1

InChI Key

RYIZEVGOWIUXFB-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD29012955

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.144

Distribution Coefficient, logD

-2.741

Water Solubility, LogSw

-1.11

Polar Surface Area

76.518

Acid Dissociation Constant (pKa)

4.80

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

86.70

S632-5330 in Drug Discovery

Included in Screening Libraries

Arginase Targeted Library (2009 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Male
  • Cardiovascular
Targets:
  • Others
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S632-5330 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S632-5330?
Check Price and Availability of S632-5330, 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 S632-5330 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S632-5330
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S632-5330
  • 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 S632-5330 available by request