2909-0028 Screening compound: 6-(BENZYLSULFANYL)-5-CYANO-2-METHYL-N-PHENYL-1,4-DIHYDRO-[4,4'-BIPYRIDINE]-3-CARBOXAMIDE

2909-0028 Screening compound: 6-(BENZYLSULFANYL)-5-CYANO-2-METHYL-N-PHENYL-1,4-DIHYDRO-[4,4'-BIPYRIDINE]-3-CARBOXAMIDE
2909-0028 Screening compound: 6-(BENZYLSULFANYL)-5-CYANO-2-METHYL-N-PHENYL-1,4-DIHYDRO-[4,4'-BIPYRIDINE]-3-CARBOXAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 2909-0028
6-(BENZYLSULFANYL)-5-CYANO-2-METHYL-N-PHENYL-1,4-DIHYDRO-[4,4'-BIPYRIDINE]-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

2909-0028

Molecular Formula

C26H22N4OS (C26 H22 N4 OS)

Compound Name

6-(BENZYLSULFANYL)-5-CYANO-2-METHYL-N-PHENYL-1,4-DIHYDRO-[4,4'-BIPYRIDINE]-3-CARBOXAMIDE

IUPAC name

n/a

SMILES

CC(NC(SCc1ccccc1)=C(C1c2ccncc2)C#N)=C1C(Nc1ccccc1)=O

InChI

InChI=1S/C26H22N4OS/c1-18-23(25(31)30-21-10-6-3-7-11-21)24(20-12-14-28-15-13-20)22(16-27)26(29-18)32-17-19-8-4-2-5-9-19/h2-15,24,29H,17H2,1H3,(H,30,31)/t24-/m0/s1

InChI Key

VFJVCSXGHVNUCL-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD00326588

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.890

Distribution Coefficient, logD

3.347

Water Solubility, LogSw

-3.93

Polar Surface Area

59.350

Acid Dissociation Constant (pKa)

7.00

Base Dissociation Constant (pKb)

4.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

11.50

2909-0028 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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

C-Met Library (15277 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Agro:
  • Agro
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2909-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2909-0028?
Check Price and Availability of 2909-0028, 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 2909-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2909-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2909-0028
  • 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 2909-0028 available by request