3729-3505 Screening compound: 4-tert-butyl-N-{4-[(naphthalen-1-yl)carbamoyl]phenyl}benzamide

3729-3505 Screening compound: 4-tert-butyl-N-{4-[(naphthalen-1-yl)carbamoyl]phenyl}benzamide
3729-3505 Screening compound: 4-tert-butyl-N-{4-[(naphthalen-1-yl)carbamoyl]phenyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3729-3505
4-tert-butyl-N-{4-[(naphthalen-1-yl)carbamoyl]phenyl}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

3729-3505

Molecular Formula

C28H26N2O2 (C28 H26 N2 O2)

Compound Name

4-tert-butyl-N-{4-[(naphthalen-1-yl)carbamoyl]phenyl}benzamide

IUPAC name

4-tert-butyl-N-{4-[(naphthalen-1-yl)carbamoyl]phenyl}benzamide

SMILES

CC(C)(C)c(cc1)ccc1C(Nc(cc1)ccc1C(Nc1cccc2ccccc12)=O)=O

InChI

InChI=1S/C28H26N2O2/c1-28(2,3)22-15-11-20(12-16-22)26(31)29-23-17-13-21(14-18-23)27(32)30-25-10-6-8-19-7-4-5-9-24(19)25/h4-18H,1-3H3,(H,29,31)(H,30,32)

InChI Key

HDVBIEOSMZEEJE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00849439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.414

Distribution Coefficient, logD

6.401

Water Solubility, LogSw

-6.90

Polar Surface Area

45.451

Acid Dissociation Constant (pKa)

8.92

Base Dissociation Constant (pKb)

-1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

3729-3505 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Lipid Metabolism Library (9174 compounds)

PLpro Library (6343 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Metabolic
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3729-3505 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3729-3505?
Check Price and Availability of 3729-3505, 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 3729-3505 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3729-3505
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3729-3505
  • 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 3729-3505 available by request