P772-0089 Screening compound: 10-(4-methoxyphenyl)-6,8,10-triazaspiro[4.5]deca-6,8-diene-7,9-diamine

P772-0089 Screening compound: 10-(4-methoxyphenyl)-6,8,10-triazaspiro[4.5]deca-6,8-diene-7,9-diamine
P772-0089 Screening compound: 10-(4-methoxyphenyl)-6,8,10-triazaspiro[4.5]deca-6,8-diene-7,9-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound P772-0089
10-(4-methoxyphenyl)-6,8,10-triazaspiro[4.5]deca-6,8-diene-7,9-diamine

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

P772-0089

Molecular Formula

C14H19N5O (C14 H19 N5 O)

Compound Name

10-(4-methoxyphenyl)-6,8,10-triazaspiro[4.5]deca-6,8-diene-7,9-diamine

IUPAC name

10-(4-methoxyphenyl)-6810-triazaspiro[4.5]deca-68-diene-79-diamine

SMILES

COc(cc1)ccc1N1C(N)=NC(N)=NC11CCCC1

InChI

InChI=1S/C14H19N5O/c1-20-11-6-4-10(5-7-11)19-13(16)17-12(15)18-14(19)8-2-3-9-14/h4-7H,2-3,8-9H2,1H3,(H4,15,16,17,18)

InChI Key

IJGFJERBVMWCDY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03448792

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

273.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.728

Distribution Coefficient, logD

-7.649

Water Solubility, LogSw

-1.41

Polar Surface Area

71.754

Acid Dissociation Constant (pKa)

17.32

Base Dissociation Constant (pKb)

15.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

P772-0089 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Proteases
  • Kinases

References: we are preparing a list of scientific research reports with P772-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P772-0089?
Check Price and Availability of P772-0089, 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 P772-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P772-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P772-0089
  • 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 P772-0089 available by request