0089-0030 Screening compound: 3,5-di-tert-butyl-N-(naphthalen-1-yl)benzamide

0089-0030 Screening compound: 3,5-di-tert-butyl-N-(naphthalen-1-yl)benzamide
0089-0030 Screening compound: 3,5-di-tert-butyl-N-(naphthalen-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0089-0030
3,5-di-tert-butyl-N-(naphthalen-1-yl)benzamide

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

0089-0030

Molecular Formula

C25H29NO (C25 H29 NO)

Compound Name

3,5-di-tert-butyl-N-(naphthalen-1-yl)benzamide

IUPAC name

35-di-tert-butyl-N-(naphthalen-1-yl)benzamide

SMILES

CC(C)(C)c1cc(C(Nc2cccc3ccccc23)=O)cc(C(C)(C)C)c1

InChI

InChI=1S/C25H29NO/c1-24(2,3)19-14-18(15-20(16-19)25(4,5)6)23(27)26-22-13-9-11-17-10-7-8-12-21(17)22/h7-16H,1-6H3,(H,26,27)

InChI Key

OVMWRDAOBVYYQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00227267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.51

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.409

Distribution Coefficient, logD

7.405

Water Solubility, LogSw

-6.99

Polar Surface Area

22.360

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

-1.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

0089-0030 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 0089-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0089-0030?
Check Price and Availability of 0089-0030, 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 0089-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0089-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0089-0030
  • 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 0089-0030 available by request