C201-0966 Screening compound: 6-[(4-methoxyphenyl)sulfonyl]nicotinic acid

C201-0966 Screening compound: 6-[(4-methoxyphenyl)sulfonyl]nicotinic acid
C201-0966 Screening compound: 6-[(4-methoxyphenyl)sulfonyl]nicotinic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-0966
6-[(4-methoxyphenyl)sulfonyl]nicotinic 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

C201-0966

Molecular Formula

C13H11NO5S (C13 H11 NO5 S)

Compound Name

6-[(4-methoxyphenyl)sulfonyl]nicotinic acid

IUPAC name

6-(4-methoxybenzenesulfonyl)pyridine-3-carboxylic acid

SMILES

COc(cc1)ccc1S(c(cc1)ncc1C(O)=O)(=O)=O

InChI

InChI=1S/C13H11NO5S/c1-19-10-3-5-11(6-4-10)20(17,18)12-7-2-9(8-14-12)13(15)16/h2-8H,1H3,(H,15,16)

InChI Key

GNCUFXAMTSWFGV-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.3

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.023

Distribution Coefficient, logD

-0.520

Water Solubility, LogSw

-2.43

Polar Surface Area

74.603

Acid Dissociation Constant (pKa)

4.86

Base Dissociation Constant (pKb)

-5.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.69

C201-0966 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C201-0966 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-0966?
Check Price and Availability of C201-0966, 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 C201-0966 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-0966
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-0966
  • 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 C201-0966 available by request