D325-0479 Screening compound: 2-(phenoxymethyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclopentane]

D325-0479 Screening compound: 2-(phenoxymethyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclopentane]
D325-0479 Screening compound: 2-(phenoxymethyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclopentane] alternative view

Chemical Structure Depiction of ChemDiv screening compound D325-0479
2-(phenoxymethyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclopentane]

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

D325-0479

Molecular Formula

C24H22N4O (C24 H22 N4 O)

Compound Name

2-(phenoxymethyl)-5H-spiro[benzo[h][1,2,4]triazolo[1,5-c]quinazoline-4,1'-cyclopentane]

IUPAC name

13'-(phenoxymethyl)-12'14'15'17'-tetraazaspiro[cyclopentane-19'-tetracyclo[8.7.0.0^{27}.0^{1115}]heptadecane]-1'(10')2'(7')3'5'11'13'16'-heptaene

SMILES

C(c1nn(cnc-2c3C4(CCCC4)Cc4c2cccc4)c3n1)Oc1ccccc1

InChI

InChI=1S/C24H22N4O/c1-2-9-18(10-3-1)29-15-20-26-23-21-22(25-16-28(23)27-20)19-11-5-4-8-17(19)14-24(21)12-6-7-13-24/h1-5,8-11,16H,6-7,12-15H2

InChI Key

DDXRYFFNMVXGDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04155156

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.354

Distribution Coefficient, logD

2.342

Water Solubility, LogSw

-4.59

Polar Surface Area

42.387

Acid Dissociation Constant (pKa)

22.49

Base Dissociation Constant (pKb)

9.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

D325-0479 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Steroid-like Compounds (494 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular
  • Metabolic
  • Immune system
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D325-0479 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D325-0479?
Check Price and Availability of D325-0479, 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 D325-0479 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D325-0479
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D325-0479
  • 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 D325-0479 available by request