4606-0769 Screening compound: N-[4-({4-[(pyrimidin-2-yl)sulfamoyl]phenyl}sulfamoyl)phenyl]acetamide

4606-0769 Screening compound: N-[4-({4-[(pyrimidin-2-yl)sulfamoyl]phenyl}sulfamoyl)phenyl]acetamide
4606-0769 Screening compound: N-[4-({4-[(pyrimidin-2-yl)sulfamoyl]phenyl}sulfamoyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4606-0769
N-[4-({4-[(pyrimidin-2-yl)sulfamoyl]phenyl}sulfamoyl)phenyl]acetamide

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

4606-0769

Molecular Formula

C18H17N5O5S2 (C18 H17 N5 O5 S2)

Compound Name

N-[4-({4-[(pyrimidin-2-yl)sulfamoyl]phenyl}sulfamoyl)phenyl]acetamide

IUPAC name

N-[4-({4-[(pyrimidin-2-yl)sulfamoyl]phenyl}sulfamoyl)phenyl]acetamide

SMILES

CC(Nc(cc1)ccc1S(Nc(cc1)ccc1S(Nc1ncccn1)(=O)=O)(=O)=O)=O

InChI

InChI=1S/C18H17N5O5S2/c1-13(24)21-14-3-7-16(8-4-14)29(25,26)22-15-5-9-17(10-6-15)30(27,28)23-18-19-11-2-12-20-18/h2-12,22H,1H3,(H,21,24)(H,19,20,23)

InChI Key

BXPIYRFTYQQXHO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03110667

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.5

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.872

Distribution Coefficient, logD

0.116

Water Solubility, LogSw

-2.67

Polar Surface Area

125.369

Acid Dissociation Constant (pKa)

6.73

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

4606-0769 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 4606-0769 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4606-0769?
Check Price and Availability of 4606-0769, 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 4606-0769 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4606-0769
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4606-0769
  • 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 4606-0769 available by request