D207-0029 Screening compound: N1,N1-diethyl-N4-[(furan-2-yl)methyl]-N4-[(pyridin-2-yl)methyl]benzene-1,4-disulfonamide

D207-0029 Screening compound: N1,N1-diethyl-N4-[(furan-2-yl)methyl]-N4-[(pyridin-2-yl)methyl]benzene-1,4-disulfonamide
D207-0029 Screening compound: N1,N1-diethyl-N4-[(furan-2-yl)methyl]-N4-[(pyridin-2-yl)methyl]benzene-1,4-disulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D207-0029
N1,N1-diethyl-N4-[(furan-2-yl)methyl]-N4-[(pyridin-2-yl)methyl]benzene-1,4-disulfonamide

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

D207-0029

Molecular Formula

C21H25N3O5S2 (C21 H25 N3 O5 S2)

Compound Name

N1,N1-diethyl-N4-[(furan-2-yl)methyl]-N4-[(pyridin-2-yl)methyl]benzene-1,4-disulfonamide

IUPAC name

N1N1-diethyl-N4-[(furan-2-yl)methyl]-N4-[(pyridin-2-yl)methyl]benzene-14-disulfonamide

SMILES

CCN(CC)S(c(cc1)ccc1S(N(Cc1ccco1)Cc1ncccc1)(=O)=O)(=O)=O

InChI

InChI=1S/C21H25N3O5S2/c1-3-23(4-2)30(25,26)20-10-12-21(13-11-20)31(27,28)24(17-19-9-7-15-29-19)16-18-8-5-6-14-22-18/h5-15H,3-4,16-17H2,1-2H3

InChI Key

FZUQPZQXWWKKFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03736993

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.58

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.763

Distribution Coefficient, logD

2.761

Water Solubility, LogSw

-3.02

Polar Surface Area

79.731

Acid Dissociation Constant (pKa)

26.84

Base Dissociation Constant (pKb)

5.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

D207-0029 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

KRAS-Targeted Library (16000 compounds)

Purinergic Library (3321 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • Kinases
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D207-0029 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D207-0029?
Check Price and Availability of D207-0029, 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 D207-0029 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D207-0029
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D207-0029
  • 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 D207-0029 available by request