4296-0606 Screening compound: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenyl-6-{[(phenylcarbamoyl)methyl]sulfanyl}pyridine-3-carboxamide

4296-0606 Screening compound: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenyl-6-{[(phenylcarbamoyl)methyl]sulfanyl}pyridine-3-carboxamide
4296-0606 Screening compound: 5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenyl-6-{[(phenylcarbamoyl)methyl]sulfanyl}pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4296-0606
5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenyl-6-{[(phenylcarbamoyl)methyl]sulfanyl}pyridine-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

4296-0606

Molecular Formula

C30H26N4O4S (C30 H26 N4 O4 S)

Compound Name

5-cyano-4-(3,4-dimethoxyphenyl)-2-methyl-N-phenyl-6-{[(phenylcarbamoyl)methyl]sulfanyl}pyridine-3-carboxamide

IUPAC name

5-cyano-4-(34-dimethoxyphenyl)-2-methyl-N-phenyl-6-{[(phenylcarbamoyl)methyl]sulfanyl}pyridine-3-carboxamide

SMILES

Cc(nc1SCC(Nc2ccccc2)=O)c(C(Nc2ccccc2)=O)c(-c(cc2)cc(OC)c2OC)c1C#N

InChI

InChI=1S/C30H26N4O4S/c1-19-27(29(36)34-22-12-8-5-9-13-22)28(20-14-15-24(37-2)25(16-20)38-3)23(17-31)30(32-19)39-18-26(35)33-21-10-6-4-7-11-21/h4-16H,18H2,1-3H3,(H,33,35)(H,34,36)

InChI Key

QAGPYCKJAIRDHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02999802

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

538.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.919

Distribution Coefficient, logD

4.919

Water Solubility, LogSw

-4.81

Polar Surface Area

87.577

Acid Dissociation Constant (pKa)

10.34

Base Dissociation Constant (pKb)

0.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

4296-0606 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4296-0606 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4296-0606?
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What is the minimum amount of 4296-0606 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4296-0606
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4296-0606
  • 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 4296-0606 available by request