C786-1509 Screening compound: 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,8-dimethyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one

C786-1509 Screening compound: 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,8-dimethyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one
C786-1509 Screening compound: 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,8-dimethyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C786-1509
2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,8-dimethyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-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

C786-1509

Molecular Formula

C24H24FN5O2 (C24 H24 FN5 O2)

Compound Name

2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-4,8-dimethyl-1H,2H-[1,2,4]triazino[4,5-a]indol-1-one

IUPAC name

2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-48-dimethyl-1H2H-[124]triazino[45-a]indol-1-one

SMILES

Cc(cc1)cc(cc23)c1n2C(C)=NN(CC(N(CC1)CCN1c(cccc1)c1F)=O)C3=O

InChI

InChI=1S/C24H24FN5O2/c1-16-7-8-20-18(13-16)14-22-24(32)29(26-17(2)30(20)22)15-23(31)28-11-9-27(10-12-28)21-6-4-3-5-19(21)25/h3-8,13-14H,9-12,15H2,1-2H3

InChI Key

SSPRQQFREPTBIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14795029

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.301

Distribution Coefficient, logD

3.301

Water Solubility, LogSw

-3.63

Polar Surface Area

48.728

Acid Dissociation Constant (pKa)

19.13

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with C786-1509 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C786-1509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C786-1509
  • 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 C786-1509 available by request