8001-0580 Screening compound: 1,2-bis({4-[(E)-{[(2-methoxyphenyl)formamido]imino}methyl]phenyl}) benzene-1,2-dicarboxylate

8001-0580 Screening compound: 1,2-bis({4-[(E)-{[(2-methoxyphenyl)formamido]imino}methyl]phenyl}) benzene-1,2-dicarboxylate
8001-0580 Screening compound: 1,2-bis({4-[(E)-{[(2-methoxyphenyl)formamido]imino}methyl]phenyl}) benzene-1,2-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8001-0580
1,2-bis({4-[(E)-{[(2-methoxyphenyl)formamido]imino}methyl]phenyl}) benzene-1,2-dicarboxylate

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

8001-0580

Molecular Formula

C38H30N4O8 (C38 H30 N4 O8)

Compound Name

1,2-bis({4-[(E)-{[(2-methoxyphenyl)formamido]imino}methyl]phenyl}) benzene-1,2-dicarboxylate

IUPAC name

12-bis({4-[(E)-{[(2-methoxyphenyl)formamido]imino}methyl]phenyl}) benzene-12-dicarboxylate

SMILES

COc(cccc1)c1C(N/N=C/c(cc1)ccc1OC(c(cccc1)c1C(Oc1ccc(/C=N/NC(c(cccc2)c2OC)=O)cc1)=O)=O)=O

InChI

InChI=1S/C38H30N4O8/c1-47-33-13-7-5-11-31(33)35(43)41-39-23-25-15-19-27(20-16-25)49-37(45)29-9-3-4-10-30(29)38(46)50-28-21-17-26(18-22-28)24-40-42-36(44)32-12-6-8-14-34(32)48-2/h3-24H,1-2H3,(H,41,43)(H,42,44)

InChI Key

OODZXNGYOMVCDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00737031

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

670.68

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

5.225

Distribution Coefficient, logD

5.086

Water Solubility, LogSw

-5.27

Polar Surface Area

126.887

Acid Dissociation Constant (pKa)

7.83

Base Dissociation Constant (pKb)

0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

References: we are preparing a list of scientific research reports with 8001-0580 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8001-0580?
Check Price and Availability of 8001-0580, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8001-0580 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8001-0580
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8001-0580
  • 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 8001-0580 available by request