S055-0499 Screening compound: N-[(2-phenoxypyridin-3-yl)methyl]cyclopropanesulfonamide

S055-0499 Screening compound: N-[(2-phenoxypyridin-3-yl)methyl]cyclopropanesulfonamide
S055-0499 Screening compound: N-[(2-phenoxypyridin-3-yl)methyl]cyclopropanesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S055-0499
N-[(2-phenoxypyridin-3-yl)methyl]cyclopropanesulfonamide

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

S055-0499

Molecular Formula

C15H16N2O3S (C15 H16 N2 O3 S)

Compound Name

N-[(2-phenoxypyridin-3-yl)methyl]cyclopropanesulfonamide

IUPAC name

N-[(2-phenoxypyridin-3-yl)methyl]cyclopropanesulfonamide

SMILES

O=S(C1CC1)(NCc(cccn1)c1Oc1ccccc1)=O

InChI

InChI=1S/C15H16N2O3S/c18-21(19,14-8-9-14)17-11-12-5-4-10-16-15(12)20-13-6-2-1-3-7-13/h1-7,10,14,17H,8-9,11H2

InChI Key

MWWSRWFELKBFLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.013

Distribution Coefficient, logD

3.012

Water Solubility, LogSw

-3.44

Polar Surface Area

59.073

Acid Dissociation Constant (pKa)

9.87

Base Dissociation Constant (pKb)

1.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

S055-0499 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with S055-0499 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S055-0499?
Check Price and Availability of S055-0499, 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 S055-0499 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S055-0499
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S055-0499
  • 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 S055-0499 available by request