1354-0008 Screening compound: 3-bromo-4-methoxy-N-(naphthalen-1-yl)benzamide

1354-0008 Screening compound: 3-bromo-4-methoxy-N-(naphthalen-1-yl)benzamide
1354-0008 Screening compound: 3-bromo-4-methoxy-N-(naphthalen-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1354-0008
3-bromo-4-methoxy-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

1354-0008

Molecular Formula

C18H14BrNO2 (C18 H14 BrNO2)

Compound Name

3-bromo-4-methoxy-N-(naphthalen-1-yl)benzamide

IUPAC name

3-bromo-4-methoxy-N-(naphthalen-1-yl)benzamide

SMILES

COc(ccc(C(Nc1cccc2ccccc12)=O)c1)c1Br

InChI

InChI=1S/C18H14BrNO2/c1-22-17-10-9-13(11-15(17)19)18(21)20-16-8-4-6-12-5-2-3-7-14(12)16/h2-11H,1H3,(H,20,21)

InChI Key

DEXXKWVKCAQMJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01078761

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.22

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.426

Distribution Coefficient, logD

4.425

Water Solubility, LogSw

-4.66

Polar Surface Area

29.991

Acid Dissociation Constant (pKa)

9.90

Base Dissociation Constant (pKb)

-2.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

1354-0008 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 1354-0008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1354-0008?
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What is the minimum amount of 1354-0008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1354-0008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1354-0008
  • 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 1354-0008 available by request