3284-0832 Screening compound: 1-(adamantan-1-yl)-3-[(E)-[(5-bromo-2-methoxyphenyl)methylidene]amino]urea

3284-0832 Screening compound: 1-(adamantan-1-yl)-3-[(E)-[(5-bromo-2-methoxyphenyl)methylidene]amino]urea
3284-0832 Screening compound: 1-(adamantan-1-yl)-3-[(E)-[(5-bromo-2-methoxyphenyl)methylidene]amino]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 3284-0832
1-(adamantan-1-yl)-3-[(E)-[(5-bromo-2-methoxyphenyl)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

3284-0832

Molecular Formula

C19H24BrN3O2 (C19 H24 BrN3 O2)

Compound Name

1-(adamantan-1-yl)-3-[(E)-[(5-bromo-2-methoxyphenyl)methylidene]amino]urea

IUPAC name

1-(adamantan-1-yl)-3-[(E)-[(5-bromo-2-methoxyphenyl)methylidene]amino]urea

SMILES

COc(cc1)c(/C=N/NC(NC2(CC(C3)C4)CC4CC3C2)=O)cc1Br

InChI

InChI=1S/C19H24BrN3O2/c1-25-17-3-2-16(20)7-15(17)11-21-23-18(24)22-19-8-12-4-13(9-19)6-14(5-12)10-19/h2-3,7,11-14H,4-6,8-10H2,1H3,(H2,22,23,24)

InChI Key

XHMUUCZFFGZNRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02003610

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.309

Distribution Coefficient, logD

5.309

Water Solubility, LogSw

-5.42

Polar Surface Area

53.414

Acid Dissociation Constant (pKa)

12.28

Base Dissociation Constant (pKb)

-1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

3284-0832 in Drug Discovery

Included in Screening Libraries

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 3284-0832 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3284-0832?
Check Price and Availability of 3284-0832, 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 3284-0832 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3284-0832
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3284-0832
  • 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 3284-0832 available by request