0832-2781 Screening compound: N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-3-(4-methylphenyl)adamantane-1-carbohydrazide

0832-2781 Screening compound: N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-3-(4-methylphenyl)adamantane-1-carbohydrazide
0832-2781 Screening compound: N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-3-(4-methylphenyl)adamantane-1-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0832-2781
N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-3-(4-methylphenyl)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

0832-2781

Molecular Formula

C26H30N2O3 (C26 H30 N2 O3)

Compound Name

N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-3-(4-methylphenyl)adamantane-1-carbohydrazide

IUPAC name

N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-3-(4-methylphenyl)adamantane-1-carbohydrazide

SMILES

Cc1ccc(C(CC(C2)C3)(CC2C2)CC23C(N/N=C/c(cc2)cc(OC)c2O)=O)cc1

InChI

InChI=1S/C26H30N2O3/c1-17-3-6-21(7-4-17)25-11-19-9-20(12-25)14-26(13-19,16-25)24(30)28-27-15-18-5-8-22(29)23(10-18)31-2/h3-8,10,15,19-20,29H,9,11-14,16H2,1-2H3,(H,28,30)

InChI Key

UIPLLABJHFBIQN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01838421

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.049

Distribution Coefficient, logD

6.035

Water Solubility, LogSw

-5.31

Polar Surface Area

59.495

Acid Dissociation Constant (pKa)

8.88

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

0832-2781 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 0832-2781 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0832-2781?
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What is the minimum amount of 0832-2781 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0832-2781
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0832-2781
  • 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 0832-2781 available by request