8005-9580 Screening compound: (3E)-3-(2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)-2,3-dihydro-1H-indol-2-one

8005-9580 Screening compound: (3E)-3-(2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)-2,3-dihydro-1H-indol-2-one
8005-9580 Screening compound: (3E)-3-(2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)-2,3-dihydro-1H-indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-9580
(3E)-3-(2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)-2,3-dihydro-1H-indol-2-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

8005-9580

Molecular Formula

C17H11N7O (C17 H11 N7 O)

Compound Name

(3E)-3-(2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)-2,3-dihydro-1H-indol-2-one

IUPAC name

(3E)-3-(2-{5H-[124]triazino[56-b]indol-3-yl}hydrazin-1-ylidene)-23-dihydro-1H-indol-2-one

SMILES

O=C1Nc(cccc2)c2/C1=N\Nc1nnc(c(cccc2)c2[nH]2)c2n1

InChI

InChI=1S/C17H11N7O/c25-16-14(10-6-2-4-8-12(10)19-16)22-24-17-20-15-13(21-23-17)9-5-1-3-7-11(9)18-15/h1-8H,(H,19,22,25)(H2,18,20,23,24)

InChI Key

PJOKOALRIYKAKZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00293287

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.395

Distribution Coefficient, logD

2.395

Water Solubility, LogSw

-3.16

Polar Surface Area

89.165

Acid Dissociation Constant (pKa)

12.89

Base Dissociation Constant (pKb)

1.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 8005-9580 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-9580?
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What is the minimum amount of 8005-9580 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-9580
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-9580
  • 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 8005-9580 available by request