C786-3343 Screening compound: 2-{8-methoxy-4-methyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-[(4-methoxyphenyl)methyl]acetamide

C786-3343 Screening compound: 2-{8-methoxy-4-methyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-[(4-methoxyphenyl)methyl]acetamide
C786-3343 Screening compound: 2-{8-methoxy-4-methyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-[(4-methoxyphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C786-3343
2-{8-methoxy-4-methyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-[(4-methoxyphenyl)methyl]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

C786-3343

Molecular Formula

C22H22N4O4 (C22 H22 N4 O4)

Compound Name

2-{8-methoxy-4-methyl-1-oxo-1H,2H-[1,2,4]triazino[4,5-a]indol-2-yl}-N-[(4-methoxyphenyl)methyl]acetamide

IUPAC name

2-{8-methoxy-4-methyl-1-oxo-1H2H-[124]triazino[45-a]indol-2-yl}-N-[(4-methoxyphenyl)methyl]acetamide

SMILES

CC(n(c1c2)c(cc3)c2cc3OC)=NN(CC(NCc(cc2)ccc2OC)=O)C1=O

InChI

InChI=1S/C22H22N4O4/c1-14-24-25(13-21(27)23-12-15-4-6-17(29-2)7-5-15)22(28)20-11-16-10-18(30-3)8-9-19(16)26(14)20/h4-11H,12-13H2,1-3H3,(H,23,27)

InChI Key

FYOFIQSMYWPFIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14795262

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.619

Distribution Coefficient, logD

2.619

Water Solubility, LogSw

-3.06

Polar Surface Area

68.935

Acid Dissociation Constant (pKa)

14.51

Base Dissociation Constant (pKb)

0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with C786-3343 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C786-3343?
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What is the minimum amount of C786-3343 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C786-3343
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C786-3343
  • 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 C786-3343 available by request