8017-9169 Screening compound: 4-(4-hydroxy-3-methoxyphenyl)-1-[(6-oxo-3-phenyl-1,6-dihydro-4-pyridazinyl)amino]-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione

8017-9169 Screening compound: 4-(4-hydroxy-3-methoxyphenyl)-1-[(6-oxo-3-phenyl-1,6-dihydro-4-pyridazinyl)amino]-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione
8017-9169 Screening compound: 4-(4-hydroxy-3-methoxyphenyl)-1-[(6-oxo-3-phenyl-1,6-dihydro-4-pyridazinyl)amino]-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9169
4-(4-hydroxy-3-methoxyphenyl)-1-[(6-oxo-3-phenyl-1,6-dihydro-4-pyridazinyl)amino]-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione

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

8017-9169

Molecular Formula

C26H24N4O5 (C26 H24 N4 O5)

Compound Name

4-(4-hydroxy-3-methoxyphenyl)-1-[(6-oxo-3-phenyl-1,6-dihydro-4-pyridazinyl)amino]-4,6,7,8-tetrahydro-2,5(1H,3H)-quinolinedione

IUPAC name

4-(4-hydroxy-3-methoxyphenyl)-1-[(6-oxo-3-phenyl-16-dihydropyridazin-4-yl)amino]-12345678-octahydroquinoline-25-dione

SMILES

COc(cc(C(CC1=O)C(C(CCC2)=O)=C2N1NC(C(c1ccccc1)=NN1)=CC1=O)cc1)c1O

InChI

InChI=1S/C26H24N4O5/c1-35-22-12-16(10-11-20(22)31)17-13-24(34)30(19-8-5-9-21(32)25(17)19)29-18-14-23(33)27-28-26(18)15-6-3-2-4-7-15/h2-4,6-7,10-12,14,17,31H,5,8-9,13H2,1H3,(H2,27,29,33)/t17-/m1/s1

InChI Key

NUSKOFBSLPMKHQ-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD06619199

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.039

Distribution Coefficient, logD

1.938

Water Solubility, LogSw

-2.71

Polar Surface Area

102.896

Acid Dissociation Constant (pKa)

10.10

Base Dissociation Constant (pKb)

6.82

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.08

References: we are preparing a list of scientific research reports with 8017-9169 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 8017-9169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9169
  • 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 8017-9169 available by request