8004-0527 Screening compound: {N},{N}'-bis{(1{E})-[4-(hexyloxy)-3-methoxyphenyl]methylene}biphenyl-4,4'-diamine

8004-0527 Screening compound: {N},{N}'-bis{(1{E})-[4-(hexyloxy)-3-methoxyphenyl]methylene}biphenyl-4,4'-diamine
8004-0527 Screening compound: {N},{N}'-bis{(1{E})-[4-(hexyloxy)-3-methoxyphenyl]methylene}biphenyl-4,4'-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-0527
{N},{N}'-bis{(1{E})-[4-(hexyloxy)-3-methoxyphenyl]methylene}biphenyl-4,4'-diamine

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

8004-0527

Molecular Formula

C40H48N2O4 (C40 H48 N2 O4)

Compound Name

{N},{N}'-bis{(1{E})-[4-(hexyloxy)-3-methoxyphenyl]methylene}biphenyl-4,4'-diamine

IUPAC name

(E)-1-[4-(hexyloxy)-3-methoxyphenyl]-N-{4'-[(E)-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}amino]-[11'-biphenyl]-4-yl}methanimine

SMILES

CCCCCCOc(ccc(/C=N/c(cc1)ccc1-c(cc1)ccc1/N=C/c(cc1)cc(OC)c1OCCCCCC)c1)c1OC

InChI

InChI=1S/C40H48N2O4/c1-5-7-9-11-25-45-37-23-13-31(27-39(37)43-3)29-41-35-19-15-33(16-20-35)34-17-21-36(22-18-34)42-30-32-14-24-38(40(28-32)44-4)46-26-12-10-8-6-2/h13-24,27-30H,5-12,25-26H2,1-4H3

InChI Key

JYBOXHQOPBTNTP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00736840

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

620.83

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

19.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

10.607

Distribution Coefficient, logD

10.584

Water Solubility, LogSw

-5.86

Polar Surface Area

46.491

Acid Dissociation Constant (pKa)

27.59

Base Dissociation Constant (pKb)

6.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with 8004-0527 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-0527?
Check Price and Availability of 8004-0527, 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 8004-0527 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-0527
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-0527
  • 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 8004-0527 available by request