8018-3635 Screening compound: N1,N5-bis[2-(adamantan-1-yloxy)ethyl]-N1,N5-dimethylnaphthalene-1,5-disulfonamide

8018-3635 Screening compound: N1,N5-bis[2-(adamantan-1-yloxy)ethyl]-N1,N5-dimethylnaphthalene-1,5-disulfonamide
8018-3635 Screening compound: N1,N5-bis[2-(adamantan-1-yloxy)ethyl]-N1,N5-dimethylnaphthalene-1,5-disulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3635
N1,N5-bis[2-(adamantan-1-yloxy)ethyl]-N1,N5-dimethylnaphthalene-1,5-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

8018-3635

Molecular Formula

C36H50N2O6S2 (C36 H50 N2 O6 S2)

Compound Name

N1,N5-bis[2-(adamantan-1-yloxy)ethyl]-N1,N5-dimethylnaphthalene-1,5-disulfonamide

IUPAC name

N1N5-bis[2-(adamantan-1-yloxy)ethyl]-N1N5-dimethylnaphthalene-15-disulfonamide

SMILES

CN(CCOC1(CC(C2)C3)CC3CC2C1)S(c1c(cccc2S(N(C)CCOC3(CC(C4)C5)CC5CC4C3)(=O)=O)c2ccc1)(=O)=O

InChI

InChI=1S/C36H50N2O6S2/c1-37(9-11-43-35-19-25-13-26(20-35)15-27(14-25)21-35)45(39,40)33-7-3-6-32-31(33)5-4-8-34(32)46(41,42)38(2)10-12-44-36-22-28-16-29(23-36)18-30(17-28)24-36/h3-8,25-30H,9-24H2,1-2H3

InChI Key

KXOXRSBSHQYZMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12131091

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

670.93

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

7.183

Distribution Coefficient, logD

7.183

Water Solubility, LogSw

-6.20

Polar Surface Area

77.574

Acid Dissociation Constant (pKa)

26.12

Base Dissociation Constant (pKb)

-7.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

72.20

8018-3635 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8018-3635 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3635?
Check Price and Availability of 8018-3635, 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 8018-3635 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3635
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3635
  • 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 8018-3635 available by request