8002-6258 Screening compound: 2,4-dibromo-6-({(E)-2-[(2,2-diphenylcyclopropyl)carbonyl]hydrazono}methyl)phenyl 3,4,5-trimethoxybenzoate

8002-6258 Screening compound: 2,4-dibromo-6-({(E)-2-[(2,2-diphenylcyclopropyl)carbonyl]hydrazono}methyl)phenyl 3,4,5-trimethoxybenzoate
8002-6258 Screening compound: 2,4-dibromo-6-({(E)-2-[(2,2-diphenylcyclopropyl)carbonyl]hydrazono}methyl)phenyl 3,4,5-trimethoxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8002-6258
2,4-dibromo-6-({(E)-2-[(2,2-diphenylcyclopropyl)carbonyl]hydrazono}methyl)phenyl 3,4,5-trimethoxybenzoate

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

8002-6258

Molecular Formula

C33H28Br2N2O6 (C33 H28 Br2 N2 O6)

Compound Name

2,4-dibromo-6-({(E)-2-[(2,2-diphenylcyclopropyl)carbonyl]hydrazono}methyl)phenyl 3,4,5-trimethoxybenzoate

IUPAC name

24-dibromo-6-[(E)-{[(22-diphenylcyclopropyl)formamido]imino}methyl]phenyl 345-trimethoxybenzoate

SMILES

COc1cc(C(Oc(c(/C=N/NC(C(C2)C2(c2ccccc2)c2ccccc2)=O)cc(Br)c2)c2Br)=O)cc(OC)c1OC

InChI

InChI=1S/C33H28Br2N2O6/c1-40-27-15-20(16-28(41-2)30(27)42-3)32(39)43-29-21(14-24(34)17-26(29)35)19-36-37-31(38)25-18-33(25,22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-17,19,25H,18H2,1-3H3,(H,37,38)/t25-/m1/s1

InChI Key

HHJCNYJZQXRHKF-RUZDIDTESA-N

MDL Number (MFCD)

MFCD00733022

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

708.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

7.554

Distribution Coefficient, logD

5.534

Water Solubility, LogSw

-5.69

Polar Surface Area

79.063

Acid Dissociation Constant (pKa)

5.38

Base Dissociation Constant (pKb)

0.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.18

References: we are preparing a list of scientific research reports with 8002-6258 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8002-6258?
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What is the minimum amount of 8002-6258 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8002-6258
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8002-6258
  • 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 8002-6258 available by request