000L-0172 Screening compound: 5-(2-methylbutoxy)-2-[(E)-[(4-pentylphenyl)imino]methyl]phenol

000L-0172 Screening compound: 5-(2-methylbutoxy)-2-[(E)-[(4-pentylphenyl)imino]methyl]phenol
000L-0172 Screening compound: 5-(2-methylbutoxy)-2-[(E)-[(4-pentylphenyl)imino]methyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 000L-0172
5-(2-methylbutoxy)-2-[(E)-[(4-pentylphenyl)imino]methyl]phenol

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

000L-0172

Molecular Formula

C23H31NO2 (C23 H31 NO2)

Compound Name

5-(2-methylbutoxy)-2-[(E)-[(4-pentylphenyl)imino]methyl]phenol

IUPAC name

5-(2-methylbutoxy)-2-[(E)-[(4-pentylphenyl)imino]methyl]phenol

SMILES

CCCCCc(cc1)ccc1/N=C/c(ccc(OCC(C)CC)c1)c1O

InChI

InChI=1S/C23H31NO2/c1-4-6-7-8-19-9-12-21(13-10-19)24-16-20-11-14-22(15-23(20)25)26-17-18(3)5-2/h9-16,18,25H,4-8,17H2,1-3H3/t18-/m0/s1

InChI Key

WSZHJQJKXKORSV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD00600530

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.627

Distribution Coefficient, logD

7.607

Water Solubility, LogSw

-5.45

Polar Surface Area

32.413

Acid Dissociation Constant (pKa)

8.76

Base Dissociation Constant (pKb)

4.91

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with 000L-0172 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 000L-0172?
Check Price and Availability of 000L-0172, 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 000L-0172 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 000L-0172
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 000L-0172
  • 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 000L-0172 available by request