8008-4157 Screening compound: 3,4,5-tris(benzyloxy)benzamide

8008-4157 Screening compound: 3,4,5-tris(benzyloxy)benzamide
8008-4157 Screening compound: 3,4,5-tris(benzyloxy)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-4157
3,4,5-tris(benzyloxy)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

8008-4157

Molecular Formula

C28H25NO4 (C28 H25 NO4)

Compound Name

3,4,5-tris(benzyloxy)benzamide

IUPAC name

345-tris(benzyloxy)benzamide

SMILES

NC(c(cc1OCc2ccccc2)cc(OCc2ccccc2)c1OCc1ccccc1)=O

InChI

InChI=1S/C28H25NO4/c29-28(30)24-16-25(31-18-21-10-4-1-5-11-21)27(33-20-23-14-8-3-9-15-23)26(17-24)32-19-22-12-6-2-7-13-22/h1-17H,18-20H2,(H2,29,30)

InChI Key

LMODUKIJYUJIPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01306363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.925

Distribution Coefficient, logD

4.925

Water Solubility, LogSw

-5.17

Polar Surface Area

56.327

Acid Dissociation Constant (pKa)

15.57

Base Dissociation Constant (pKb)

-2.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.71

8008-4157 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8008-4157 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-4157?
Check Price and Availability of 8008-4157, 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 8008-4157 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-4157
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-4157
  • 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 8008-4157 available by request