1348-1187 Screening compound: (1E)-1-[(3-bromo-4-methoxyphenyl)methylidene]-2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazine

1348-1187 Screening compound: (1E)-1-[(3-bromo-4-methoxyphenyl)methylidene]-2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazine
1348-1187 Screening compound: (1E)-1-[(3-bromo-4-methoxyphenyl)methylidene]-2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1348-1187
(1E)-1-[(3-bromo-4-methoxyphenyl)methylidene]-2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazine

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

1348-1187

Molecular Formula

C17H13BrN6O (C17 H13 BrN6 O)

Compound Name

(1E)-1-[(3-bromo-4-methoxyphenyl)methylidene]-2-{5H-[1,2,4]triazino[5,6-b]indol-3-yl}hydrazine

IUPAC name

(1E)-1-[(3-bromo-4-methoxyphenyl)methylidene]-2-{5H-[124]triazino[56-b]indol-3-yl}hydrazine

SMILES

COc(ccc(/C=N/Nc1nnc(c(cccc2)c2[nH]2)c2n1)c1)c1Br

InChI

InChI=1S/C17H13BrN6O/c1-25-14-7-6-10(8-12(14)18)9-19-23-17-21-16-15(22-24-17)11-4-2-3-5-13(11)20-16/h2-9H,1H3,(H2,20,21,23,24)

InChI Key

GEDHIJWNMIJBGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00293685

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.23

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.479

Distribution Coefficient, logD

3.479

Water Solubility, LogSw

-3.90

Polar Surface Area

72.986

Acid Dissociation Constant (pKa)

13.22

Base Dissociation Constant (pKb)

3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

1348-1187 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1348-1187 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 1348-1187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1348-1187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1348-1187
  • 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 1348-1187 available by request