4896-4636 Screening compound: 2-[(1E)-2-[8-(benzyloxy)quinolin-2-yl]ethenyl]-6-ethoxyphenol

4896-4636 Screening compound: 2-[(1E)-2-[8-(benzyloxy)quinolin-2-yl]ethenyl]-6-ethoxyphenol
4896-4636 Screening compound: 2-[(1E)-2-[8-(benzyloxy)quinolin-2-yl]ethenyl]-6-ethoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 4896-4636
2-[(1E)-2-[8-(benzyloxy)quinolin-2-yl]ethenyl]-6-ethoxyphenol

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

4896-4636

Molecular Formula

C26H23NO3 (C26 H23 NO3)

Compound Name

2-[(1E)-2-[8-(benzyloxy)quinolin-2-yl]ethenyl]-6-ethoxyphenol

IUPAC name

2-[(1E)-2-[8-(benzyloxy)quinolin-2-yl]ethenyl]-6-ethoxyphenol

SMILES

CCOc1cccc(/C=C/c2ccc(cccc3OCc4ccccc4)c3n2)c1O

InChI

InChI=1S/C26H23NO3/c1-2-29-24-13-7-11-21(26(24)28)15-17-22-16-14-20-10-6-12-23(25(20)27-22)30-18-19-8-4-3-5-9-19/h3-17,28H,2,18H2,1H3

InChI Key

NFZSHIIXXJHQGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02951904

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

397.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.277

Distribution Coefficient, logD

6.240

Water Solubility, LogSw

-6.57

Polar Surface Area

39.567

Acid Dissociation Constant (pKa)

8.45

Base Dissociation Constant (pKb)

3.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

4896-4636 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4896-4636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4896-4636?
Check Price and Availability of 4896-4636, 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 4896-4636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4896-4636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4896-4636
  • 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 4896-4636 available by request