0832-2771 Screening compound: 3-(4-methylphenyl)-N'-[(E)-[4-(octyloxy)phenyl]methylidene]adamantane-1-carbohydrazide

0832-2771 Screening compound: 3-(4-methylphenyl)-N'-[(E)-[4-(octyloxy)phenyl]methylidene]adamantane-1-carbohydrazide
0832-2771 Screening compound: 3-(4-methylphenyl)-N'-[(E)-[4-(octyloxy)phenyl]methylidene]adamantane-1-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0832-2771
3-(4-methylphenyl)-N'-[(E)-[4-(octyloxy)phenyl]methylidene]adamantane-1-carbohydrazide

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

0832-2771

Molecular Formula

C33H44N2O2 (C33 H44 N2 O2)

Compound Name

3-(4-methylphenyl)-N'-[(E)-[4-(octyloxy)phenyl]methylidene]adamantane-1-carbohydrazide

IUPAC name

3-(4-methylphenyl)-N'-[(E)-[4-(octyloxy)phenyl]methylidene]adamantane-1-carbohydrazide

SMILES

CCCCCCCCOc1ccc(/C=N/NC(C(CC(C2)C3)(CC2C2)CC23c2ccc(C)cc2)=O)cc1

InChI

InChI=1S/C33H44N2O2/c1-3-4-5-6-7-8-17-37-30-15-11-26(12-16-30)23-34-35-31(36)33-21-27-18-28(22-33)20-32(19-27,24-33)29-13-9-25(2)10-14-29/h9-16,23,27-28H,3-8,17-22,24H2,1-2H3,(H,35,36)

InChI Key

XFTSRYCWWQCJIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01838416

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.72

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

10.171

Distribution Coefficient, logD

10.143

Water Solubility, LogSw

-5.79

Polar Surface Area

42.734

Acid Dissociation Constant (pKa)

8.58

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.60

0832-2771 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Regenerative Medicine Focused Library (23016 compounds)

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

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • 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 0832-2771 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0832-2771?
Check Price and Availability of 0832-2771, 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 0832-2771 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0832-2771
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0832-2771
  • 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 0832-2771 available by request