K691-0182 Screening compound: N4,N4'-bis[(4-methoxyphenyl)methyl]-[1,1'-biphenyl]-4,4'-disulfonamide

K691-0182 Screening compound: N4,N4'-bis[(4-methoxyphenyl)methyl]-[1,1'-biphenyl]-4,4'-disulfonamide
K691-0182 Screening compound: N4,N4'-bis[(4-methoxyphenyl)methyl]-[1,1'-biphenyl]-4,4'-disulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K691-0182
N4,N4'-bis[(4-methoxyphenyl)methyl]-[1,1'-biphenyl]-4,4'-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

K691-0182

Molecular Formula

C28H28N2O6S2 (C28 H28 N2 O6 S2)

Compound Name

N4,N4'-bis[(4-methoxyphenyl)methyl]-[1,1'-biphenyl]-4,4'-disulfonamide

IUPAC name

N4N4'-bis[(4-methoxyphenyl)methyl]-[11'-biphenyl]-44'-disulfonamide

SMILES

COc1ccc(CNS(c(cc2)ccc2-c(cc2)ccc2S(NCc(cc2)ccc2OC)(=O)=O)(=O)=O)cc1

InChI

InChI=1S/C28H28N2O6S2/c1-35-25-11-3-21(4-12-25)19-29-37(31,32)27-15-7-23(8-16-27)24-9-17-28(18-10-24)38(33,34)30-20-22-5-13-26(36-2)14-6-22/h3-18,29-30H,19-20H2,1-2H3

InChI Key

OOTVBEMYZBQKHB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02936444

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

552.67

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.387

Distribution Coefficient, logD

5.387

Water Solubility, LogSw

-5.78

Polar Surface Area

98.571

Acid Dissociation Constant (pKa)

11.08

Base Dissociation Constant (pKb)

-6.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

K691-0182 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

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

Glucocorticoid receptors Library (4806 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Nuclear receptors
  • Proteases
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K691-0182 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K691-0182?
Check Price and Availability of K691-0182, 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 K691-0182 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K691-0182
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K691-0182
  • 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 K691-0182 available by request