8013-3107 Screening compound: 10-(4-methoxyphenyl)-9H-indeno[1,2-d][1,2,4]triazolo[1,5-a]pyrimidin-9-one

8013-3107 Screening compound: 10-(4-methoxyphenyl)-9H-indeno[1,2-d][1,2,4]triazolo[1,5-a]pyrimidin-9-one
8013-3107 Screening compound: 10-(4-methoxyphenyl)-9H-indeno[1,2-d][1,2,4]triazolo[1,5-a]pyrimidin-9-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-3107
10-(4-methoxyphenyl)-9H-indeno[1,2-d][1,2,4]triazolo[1,5-a]pyrimidin-9-one

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

8013-3107

Molecular Formula

C19H12N4O2 (C19 H12 N4 O2)

Compound Name

10-(4-methoxyphenyl)-9H-indeno[1,2-d][1,2,4]triazolo[1,5-a]pyrimidin-9-one

IUPAC name

10-(4-methoxyphenyl)-11121416-tetraazatetracyclo[7.7.0.0^{27}.0^{1115}]hexadeca-1(16)24691214-heptaen-8-one

SMILES

COc(cc1)ccc1-c(n1ncnc1nc1-c2c3cccc2)c1C3=O

InChI

InChI=1S/C19H12N4O2/c1-25-12-8-6-11(7-9-12)17-15-16(22-19-20-10-21-23(17)19)13-4-2-3-5-14(13)18(15)24/h2-10H,1H3

InChI Key

WCFGCPGEXVOJHE-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.095

Distribution Coefficient, logD

3.095

Water Solubility, LogSw

-3.59

Polar Surface Area

55.539

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

References: we are preparing a list of scientific research reports with 8013-3107 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-3107?
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What is the minimum amount of 8013-3107 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-3107
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-3107
  • 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 8013-3107 available by request