FF20-0316 Screening compound: 1-methanesulfonyl-4-(pyridin-2-yl)pyrrolidine-3-carboxylic acid

FF20-0316 Screening compound: 1-methanesulfonyl-4-(pyridin-2-yl)pyrrolidine-3-carboxylic acid
FF20-0316 Screening compound: 1-methanesulfonyl-4-(pyridin-2-yl)pyrrolidine-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound FF20-0316
1-methanesulfonyl-4-(pyridin-2-yl)pyrrolidine-3-carboxylic 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

FF20-0316

Molecular Formula

C11H14N2O4S (C11 H14 N2 O4 S)

Compound Name

1-methanesulfonyl-4-(pyridin-2-yl)pyrrolidine-3-carboxylic acid

IUPAC name

(3R4R)-1-methanesulfonyl-4-(pyridin-2-yl)pyrrolidine-3-carboxylic acid

SMILES

CS(N(C[C@@H]1C(O)=O)C[C@@H]1c1ncccc1)(=O)=O

InChI

InChI=1S/C11H14N2O4S/c1-18(16,17)13-6-8(9(7-13)11(14)15)10-4-2-3-5-12-10/h2-5,8-9H,6-7H2,1H3,(H,14,15)/t8-,9-/m1/s1

InChI Key

TYARAARFQHFTPN-RKDXNWHRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.31

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

-0.546

Distribution Coefficient, logD

-3.092

Water Solubility, LogSw

-2.05

Polar Surface Area

69.131

Acid Dissociation Constant (pKa)

4.86

Base Dissociation Constant (pKb)

4.52

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

45.46

FF20-0316 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

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

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with FF20-0316 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound FF20-0316?
Check Price and Availability of FF20-0316, 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 FF20-0316 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for FF20-0316
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for FF20-0316
  • 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 FF20-0316 available by request