3284-0822 Screening compound: 3-(adamantan-1-yl)-1-[(E)-[(pyridin-3-yl)methylidene]amino]urea

3284-0822 Screening compound: 3-(adamantan-1-yl)-1-[(E)-[(pyridin-3-yl)methylidene]amino]urea
3284-0822 Screening compound: 3-(adamantan-1-yl)-1-[(E)-[(pyridin-3-yl)methylidene]amino]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3284-0822
3-(adamantan-1-yl)-1-[(E)-[(pyridin-3-yl)methylidene]amino]urea

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

3284-0822

Molecular Formula

C17H22N4O (C17 H22 N4 O)

Compound Name

3-(adamantan-1-yl)-1-[(E)-[(pyridin-3-yl)methylidene]amino]urea

IUPAC name

3-(adamantan-1-yl)-1-[(E)-[(pyridin-3-yl)methylidene]amino]urea

SMILES

O=C(NC1(CC(C2)C3)CC3CC2C1)N/N=C/c1cnccc1

InChI

InChI=1S/C17H22N4O/c22-16(21-19-11-12-2-1-3-18-10-12)20-17-7-13-4-14(8-17)6-15(5-13)9-17/h1-3,10-11,13-15H,4-9H2,(H2,20,21,22)

InChI Key

GFEDPAQQVVYRDD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02003605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.181

Distribution Coefficient, logD

3.181

Water Solubility, LogSw

-3.03

Polar Surface Area

55.302

Acid Dissociation Constant (pKa)

12.19

Base Dissociation Constant (pKb)

-2.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

3284-0822 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 3284-0822 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3284-0822?
Check Price and Availability of 3284-0822, 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 3284-0822 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3284-0822
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3284-0822
  • 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 3284-0822 available by request