C797-1440 Screening compound: 2-{4-ethyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-(3-phenylpropyl)acetamide

C797-1440 Screening compound: 2-{4-ethyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-(3-phenylpropyl)acetamide
C797-1440 Screening compound: 2-{4-ethyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-(3-phenylpropyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C797-1440
2-{4-ethyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-(3-phenylpropyl)acetamide

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

C797-1440

Molecular Formula

C23H24N4O2 (C23 H24 N4 O2)

Compound Name

2-{4-ethyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-(3-phenylpropyl)acetamide

IUPAC name

2-{4-ethyl-1-oxo-1H2H-[124]triazino[45-a]indol-2-yl}-N-(3-phenylpropyl)acetamide

SMILES

CCC(n(c1c2)c3c2cccc3)=NN(CC(NCCCc2ccccc2)=O)C1=O

InChI

InChI=1S/C23H24N4O2/c1-2-21-25-26(16-22(28)24-14-8-11-17-9-4-3-5-10-17)23(29)20-15-18-12-6-7-13-19(18)27(20)21/h3-7,9-10,12-13,15H,2,8,11,14,16H2,1H3,(H,24,28)

InChI Key

WQWQIPWOPPBYTG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14798695

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.691

Distribution Coefficient, logD

3.691

Water Solubility, LogSw

-3.93

Polar Surface Area

54.781

Acid Dissociation Constant (pKa)

15.23

Base Dissociation Constant (pKb)

2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

C797-1440 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C797-1440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C797-1440?
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What is the minimum amount of C797-1440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C797-1440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C797-1440
  • 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 C797-1440 available by request