F296-0502 Screening compound: 5-{[(5-chloro-2-methoxyphenyl)sulfonyl]amino}-6-[[2-(dimethylamino)ethyl](ethyl)amino]nicotinic acid

F296-0502 Screening compound: 5-{[(5-chloro-2-methoxyphenyl)sulfonyl]amino}-6-[[2-(dimethylamino)ethyl](ethyl)amino]nicotinic acid
F296-0502 Screening compound: 5-{[(5-chloro-2-methoxyphenyl)sulfonyl]amino}-6-[[2-(dimethylamino)ethyl](ethyl)amino]nicotinic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound F296-0502
5-{[(5-chloro-2-methoxyphenyl)sulfonyl]amino}-6-[[2-(dimethylamino)ethyl](ethyl)amino]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

F296-0502

Molecular Formula

C19H25ClN4O5S (C19 H25 ClN4 O5 S)

Compound Name

5-{[(5-chloro-2-methoxyphenyl)sulfonyl]amino}-6-[[2-(dimethylamino)ethyl](ethyl)amino]nicotinic acid

IUPAC name

5-(5-chloro-2-methoxybenzenesulfonamido)-6-{[2-(dimethylamino)ethyl](ethyl)amino}pyridine-3-carboxylic acid

SMILES

CCN(CCN(C)C)c(ncc(C(O)=O)c1)c1NS(c(cc(cc1)Cl)c1OC)(=O)=O

InChI

InChI=1S/C19H25ClN4O5S/c1-5-24(9-8-23(2)3)18-15(10-13(12-21-18)19(25)26)22-30(27,28)17-11-14(20)6-7-16(17)29-4/h6-7,10-12,22H,5,8-9H2,1-4H3,(H,25,26)

InChI Key

ICDTWXSKDXWGDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27113912

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

456.95

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.834

Distribution Coefficient, logD

2.834

Water Solubility, LogSw

-3.42

Polar Surface Area

92.155

Acid Dissociation Constant (pKa)

4.25

Base Dissociation Constant (pKb)

8.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.84

F296-0502 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • GPCR
  • Ion Channels
  • Kinases

References: we are preparing a list of scientific research reports with F296-0502 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F296-0502?
Check Price and Availability of F296-0502, 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 F296-0502 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F296-0502
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F296-0502
  • 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 F296-0502 available by request