0712-0061 Screening compound: 2-[(E)-(2-{5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-5-methoxyphenol

0712-0061 Screening compound: 2-[(E)-(2-{5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-5-methoxyphenol
0712-0061 Screening compound: 2-[(E)-(2-{5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-5-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0712-0061
2-[(E)-(2-{5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazin-1-ylidene)methyl]-5-methoxyphenol

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

0712-0061

Molecular Formula

C19H18N6O2 (C19 H18 N6 O2)

Compound Name

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

IUPAC name

2-[(E)-(2-{5-ethyl-5H-[124]triazino[56-b]indol-3-yl}hydrazin-1-ylidene)methyl]-5-methoxyphenol

SMILES

CCn1c2nc(N/N=C/c(ccc(OC)c3)c3O)nnc2c2c1cccc2

InChI

InChI=1S/C19H18N6O2/c1-3-25-15-7-5-4-6-14(15)17-18(25)21-19(24-22-17)23-20-11-12-8-9-13(27-2)10-16(12)26/h4-11,26H,3H2,1-2H3,(H,21,23,24)

InChI Key

AMMNQFWHYAAZRF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00640534

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.005

Distribution Coefficient, logD

4.000

Water Solubility, LogSw

-3.76

Polar Surface Area

80.616

Acid Dissociation Constant (pKa)

9.76

Base Dissociation Constant (pKb)

5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

0712-0061 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0712-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0712-0061?
Check Price and Availability of 0712-0061, 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 0712-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0712-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0712-0061
  • 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 0712-0061 available by request