M359-0098 Screening compound: 6-({2-[2-(4-bromophenyl)acetamido]ethyl}sulfanyl)-N-phenylpyridine-3-carboxamide

M359-0098 Screening compound: 6-({2-[2-(4-bromophenyl)acetamido]ethyl}sulfanyl)-N-phenylpyridine-3-carboxamide
M359-0098 Screening compound: 6-({2-[2-(4-bromophenyl)acetamido]ethyl}sulfanyl)-N-phenylpyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M359-0098
6-({2-[2-(4-bromophenyl)acetamido]ethyl}sulfanyl)-N-phenylpyridine-3-carboxamide

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

M359-0098

Molecular Formula

C22H20BrN3O2S (C22 H20 BrN3 O2 S)

Compound Name

6-({2-[2-(4-bromophenyl)acetamido]ethyl}sulfanyl)-N-phenylpyridine-3-carboxamide

IUPAC name

6-({2-[2-(4-bromophenyl)acetamido]ethyl}sulfanyl)-N-phenylpyridine-3-carboxamide

SMILES

O=C(Cc(cc1)ccc1Br)NCCSc(cc1)ncc1C(Nc1ccccc1)=O

InChI

InChI=1S/C22H20BrN3O2S/c23-18-9-6-16(7-10-18)14-20(27)24-12-13-29-21-11-8-17(15-25-21)22(28)26-19-4-2-1-3-5-19/h1-11,15H,12-14H2,(H,24,27)(H,26,28)

InChI Key

XVTPDTPRDYYVCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27538852

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

470.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.806

Distribution Coefficient, logD

3.806

Water Solubility, LogSw

-4.09

Polar Surface Area

55.870

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

0.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

M359-0098 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with M359-0098 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M359-0098?
Check Price and Availability of M359-0098, 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 M359-0098 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M359-0098
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M359-0098
  • 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 M359-0098 available by request