K048-0057 Screening compound: 8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbaldehyde 9-(2,4,6-trichlorophenyl)hydrazone

K048-0057 Screening compound: 8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbaldehyde 9-(2,4,6-trichlorophenyl)hydrazone
K048-0057 Screening compound: 8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbaldehyde 9-(2,4,6-trichlorophenyl)hydrazone alternative view

Chemical Structure Depiction of ChemDiv screening compound K048-0057
8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbaldehyde 9-(2,4,6-trichlorophenyl)hydrazone

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

K048-0057

Molecular Formula

C19H18Cl3N3O (C19 H18 Cl3 N3 O)

Compound Name

8-hydroxy-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-carbaldehyde 9-(2,4,6-trichlorophenyl)hydrazone

IUPAC name

7-[(E)-[2-(246-trichlorophenyl)hydrazin-1-ylidene]methyl]-1-azatricyclo[7.3.1.0^{513}]trideca-579(13)-trien-6-ol

SMILES

Oc1c(/C=N/Nc(c(Cl)cc(Cl)c2)c2Cl)cc2c3c1CCCN3CCC2

InChI

InChI=1S/C19H18Cl3N3O/c20-13-8-15(21)17(16(22)9-13)24-23-10-12-7-11-3-1-5-25-6-2-4-14(18(11)25)19(12)26/h7-10,24,26H,1-6H2

InChI Key

XMSPLKOZEILZPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01248540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.73

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.851

Distribution Coefficient, logD

5.842

Water Solubility, LogSw

-5.65

Polar Surface Area

39.342

Acid Dissociation Constant (pKa)

11.83

Base Dissociation Constant (pKb)

5.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

References: we are preparing a list of scientific research reports with K048-0057 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K048-0057?
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What is the minimum amount of K048-0057 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K048-0057
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K048-0057
  • 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 K048-0057 available by request