8018-8288 Screening compound: 2-[5-(2-furyl)-1H-pyrazol-3-yl]-8,9-dihydro-7H-cyclopenta[e][1,2,4]triazolo[1,5-c]pyrimidine

8018-8288 Screening compound: 2-[5-(2-furyl)-1H-pyrazol-3-yl]-8,9-dihydro-7H-cyclopenta[e][1,2,4]triazolo[1,5-c]pyrimidine
8018-8288 Screening compound: 2-[5-(2-furyl)-1H-pyrazol-3-yl]-8,9-dihydro-7H-cyclopenta[e][1,2,4]triazolo[1,5-c]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8288
2-[5-(2-furyl)-1H-pyrazol-3-yl]-8,9-dihydro-7H-cyclopenta[e][1,2,4]triazolo[1,5-c]pyrimidine

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

8018-8288

Molecular Formula

C15H12N6O (C15 H12 N6 O)

Compound Name

2-[5-(2-furyl)-1H-pyrazol-3-yl]-8,9-dihydro-7H-cyclopenta[e][1,2,4]triazolo[1,5-c]pyrimidine

IUPAC name

4-[5-(furan-2-yl)-1H-pyrazol-3-yl]-3568-tetraazatricyclo[7.3.0.0^{26}]dodeca-1(9)247-tetraene

SMILES

C(C1)Cc2c1c1nc(-c3n[nH]c(-c4ccco4)c3)nn1cn2

InChI

InChI=1S/C15H12N6O/c1-3-9-10(4-1)16-8-21-15(9)17-14(20-21)12-7-11(18-19-12)13-5-2-6-22-13/h2,5-8H,1,3-4H2,(H,18,19)

InChI Key

TWYOZRNUBWXXAI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09062648

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.703

Distribution Coefficient, logD

1.698

Water Solubility, LogSw

-1.74

Polar Surface Area

65.158

Acid Dissociation Constant (pKa)

7.44

Base Dissociation Constant (pKb)

5.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8018-8288 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-8288 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8288?
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What is the minimum amount of 8018-8288 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8288
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8288
  • 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 8018-8288 available by request