S064-0210 Screening compound: 4-FLUORO-N-[1-(3-METHOXYPYRAZIN-2-YL)PYRROLIDIN-3-YL]BENZENE-1-SULFONAMIDE

S064-0210 Screening compound: 4-FLUORO-N-[1-(3-METHOXYPYRAZIN-2-YL)PYRROLIDIN-3-YL]BENZENE-1-SULFONAMIDE
S064-0210 Screening compound: 4-FLUORO-N-[1-(3-METHOXYPYRAZIN-2-YL)PYRROLIDIN-3-YL]BENZENE-1-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound S064-0210
4-FLUORO-N-[1-(3-METHOXYPYRAZIN-2-YL)PYRROLIDIN-3-YL]BENZENE-1-SULFONAMIDE

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

S064-0210

Molecular Formula

C15H17FN4O3S (C15 H17 FN4 O3 S)

Compound Name

4-FLUORO-N-[1-(3-METHOXYPYRAZIN-2-YL)PYRROLIDIN-3-YL]BENZENE-1-SULFONAMIDE

IUPAC name

4-fluoro-N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]benzene-1-sulfonamide

SMILES

COc1nccnc1N(CC1)CC1NS(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C15H17FN4O3S/c1-23-15-14(17-7-8-18-15)20-9-6-12(10-20)19-24(21,22)13-4-2-11(16)3-5-13/h2-5,7-8,12,19H,6,9-10H2,1H3/t12-/m0/s1

InChI Key

QAFFDFCEIQRZMN-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD29031023

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.438

Distribution Coefficient, logD

2.438

Water Solubility, LogSw

-2.78

Polar Surface Area

71.825

Acid Dissociation Constant (pKa)

10.95

Base Dissociation Constant (pKb)

0.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

S064-0210 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S064-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S064-0210?
Check Price and Availability of S064-0210, 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 S064-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S064-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S064-0210
  • 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 S064-0210 available by request