M594-1159 Screening compound: 3-bromo-N-[(2-phenylpyridin-3-yl)methyl]benzamide

M594-1159 Screening compound: 3-bromo-N-[(2-phenylpyridin-3-yl)methyl]benzamide
M594-1159 Screening compound: 3-bromo-N-[(2-phenylpyridin-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M594-1159
3-bromo-N-[(2-phenylpyridin-3-yl)methyl]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

M594-1159

Molecular Formula

C19H15BrN2O (C19 H15 BrN2 O)

Compound Name

3-bromo-N-[(2-phenylpyridin-3-yl)methyl]benzamide

IUPAC name

3-bromo-N-[(2-phenylpyridin-3-yl)methyl]benzamide

SMILES

O=C(c1cccc(Br)c1)NCc1c(-c2ccccc2)nccc1

InChI

InChI=1S/C19H15BrN2O/c20-17-10-4-8-15(12-17)19(23)22-13-16-9-5-11-21-18(16)14-6-2-1-3-7-14/h1-12H,13H2,(H,22,23)

InChI Key

BBNNTJSDRSCGNX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27548541

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.24

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.156

Distribution Coefficient, logD

4.155

Water Solubility, LogSw

-4.36

Polar Surface Area

34.198

Acid Dissociation Constant (pKa)

10.30

Base Dissociation Constant (pKb)

4.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

M594-1159 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Immunological Library (6760 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Mechanism of action:
  • PPI modulators
Targets:
  • Others

References: we are preparing a list of scientific research reports with M594-1159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M594-1159?
Check Price and Availability of M594-1159, 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 M594-1159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M594-1159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M594-1159
  • 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 M594-1159 available by request