1634-0040 Screening compound: 3,5-di-tert-butyl-4-hydroxybenzaldehyde

1634-0040 Screening compound: 3,5-di-tert-butyl-4-hydroxybenzaldehyde
1634-0040 Screening compound: 3,5-di-tert-butyl-4-hydroxybenzaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound 1634-0040
3,5-di-tert-butyl-4-hydroxybenzaldehyde

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

1634-0040

Molecular Formula

C15H22O2 (C15 H22 O2)

Compound Name

3,5-di-tert-butyl-4-hydroxybenzaldehyde

IUPAC name

35-di-tert-butyl-4-hydroxybenzaldehyde

SMILES

CC(C)(C)c1cc(C=O)cc(C(C)(C)C)c1O

InChI

InChI=1S/C15H22O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-9,17H,1-6H3

InChI Key

DOZRDZLFLOODMB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00008826

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.171

Distribution Coefficient, logD

4.156

Water Solubility, LogSw

-4.07

Polar Surface Area

29.877

Acid Dissociation Constant (pKa)

8.86

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

1634-0040 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 1634-0040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1634-0040?
Check Price and Availability of 1634-0040, 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 1634-0040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1634-0040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1634-0040
  • 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 1634-0040 available by request