0892-0509 Screening compound: N-(4-bromophenyl)-2-{[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetamide

0892-0509 Screening compound: N-(4-bromophenyl)-2-{[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetamide
0892-0509 Screening compound: N-(4-bromophenyl)-2-{[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0892-0509
N-(4-bromophenyl)-2-{[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetamide

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

0892-0509

Molecular Formula

C27H20BrN3O2S (C27 H20 BrN3 O2 S)

Compound Name

N-(4-bromophenyl)-2-{[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetamide

IUPAC name

N-(4-bromophenyl)-2-{[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetamide

SMILES

COc(cc1)ccc1-c(cc(-c1ccccc1)nc1SCC(Nc(cc2)ccc2Br)=O)c1C#N

InChI

InChI=1S/C27H20BrN3O2S/c1-33-22-13-7-18(8-14-22)23-15-25(19-5-3-2-4-6-19)31-27(24(23)16-29)34-17-26(32)30-21-11-9-20(28)10-12-21/h2-15H,17H2,1H3,(H,30,32)

InChI Key

JOCPUTPDMFLTDX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00315824

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

530.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.417

Distribution Coefficient, logD

7.417

Water Solubility, LogSw

-5.76

Polar Surface Area

55.920

Acid Dissociation Constant (pKa)

10.95

Base Dissociation Constant (pKb)

-0.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.40

References: we are preparing a list of scientific research reports with 0892-0509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0892-0509?
Check Price and Availability of 0892-0509, 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 0892-0509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0892-0509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0892-0509
  • 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 0892-0509 available by request