0149-0050 Screening compound: 4-{[bis(2-hydroxyethyl)amino]methyl}-2,6-di-tert-butylphenol

0149-0050 Screening compound: 4-{[bis(2-hydroxyethyl)amino]methyl}-2,6-di-tert-butylphenol
0149-0050 Screening compound: 4-{[bis(2-hydroxyethyl)amino]methyl}-2,6-di-tert-butylphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0149-0050
4-{[bis(2-hydroxyethyl)amino]methyl}-2,6-di-tert-butylphenol

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

0149-0050

Molecular Formula

C19H33NO3 (C19 H33 NO3)

Compound Name

4-{[bis(2-hydroxyethyl)amino]methyl}-2,6-di-tert-butylphenol

IUPAC name

4-{[bis(2-hydroxyethyl)amino]methyl}-26-di-tert-butylphenol

SMILES

CC(C)(C)c1cc(CN(CCO)CCO)cc(C(C)(C)C)c1O

InChI

InChI=1S/C19H33NO3/c1-18(2,3)15-11-14(13-20(7-9-21)8-10-22)12-16(17(15)23)19(4,5)6/h11-12,21-23H,7-10,13H2,1-6H3

InChI Key

WUXCIWVRVOPALZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00398456

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.227

Distribution Coefficient, logD

-1.335

Water Solubility, LogSw

-3.15

Polar Surface Area

52.969

Acid Dissociation Constant (pKa)

11.30

Base Dissociation Constant (pKb)

12.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.40

0149-0050 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Human Kinases Annotated Library (2415 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 0149-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0149-0050?
Check Price and Availability of 0149-0050, 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 0149-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0149-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0149-0050
  • 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 0149-0050 available by request