8009-4784 Screening compound: N',N''-{(1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-diyl)di[(E)methylylidene]}dibenzohydrazide

8009-4784 Screening compound: N',N''-{(1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-diyl)di[(E)methylylidene]}dibenzohydrazide
8009-4784 Screening compound: N',N''-{(1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-diyl)di[(E)methylylidene]}dibenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-4784
N',N''-{(1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-diyl)di[(E)methylylidene]}dibenzohydrazide

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

8009-4784

Molecular Formula

C44H42N4O8 (C44 H42 N4 O8)

Compound Name

N',N''-{(1,1',6,6',7,7'-hexahydroxy-5,5'-diisopropyl-3,3'-dimethyl-2,2'-binaphthalene-8,8'-diyl)di[(E)methylylidene]}dibenzohydrazide

IUPAC name

N'-[(E)-{11'66'77'-hexahydroxy-33'-dimethyl-8'-[(E)-[(phenylformamido)imino]methyl]-55'-bis(propan-2-yl)-[22'-binaphthalen]-8-yl}methylidene]benzohydrazide

SMILES

CC(C)c1c(cc(C)c(-c2c(C)cc(c(C(C)C)c(c(O)c3/C=N/NC(c4ccccc4)=O)O)c3c2O)c2O)c2c(/C=N/NC(c2ccccc2)=O)c(O)c1O

InChI

InChI=1S/C44H42N4O8/c1-21(2)31-27-17-23(5)33(39(51)35(27)29(37(49)41(31)53)19-45-47-43(55)25-13-9-7-10-14-25)34-24(6)18-28-32(22(3)4)42(54)38(50)30(36(28)40(34)52)20-46-48-44(56)26-15-11-8-12-16-26/h7-22,49-54H,1-6H3,(H,47,55)(H,48,56)

InChI Key

QJWMMDMDBMECEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00308990

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

754.84

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

8.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

10.518

Distribution Coefficient, logD

10.516

Water Solubility, LogSw

-6.02

Polar Surface Area

162.930

Acid Dissociation Constant (pKa)

9.75

Base Dissociation Constant (pKb)

0.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.18

8009-4784 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

MCL1 Targeted Library (12200 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8009-4784 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-4784?
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What is the minimum amount of 8009-4784 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-4784
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-4784
  • 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 8009-4784 available by request