2909-0303 Screening compound: 5-cyano-6-({[(4-ethylphenyl)carbamoyl]methyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide

2909-0303 Screening compound: 5-cyano-6-({[(4-ethylphenyl)carbamoyl]methyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
2909-0303 Screening compound: 5-cyano-6-({[(4-ethylphenyl)carbamoyl]methyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2909-0303
5-cyano-6-({[(4-ethylphenyl)carbamoyl]methyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-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

2909-0303

Molecular Formula

C29H28N4O2S2 (C29 H28 N4 O2 S2)

Compound Name

5-cyano-6-({[(4-ethylphenyl)carbamoyl]methyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide

IUPAC name

5-cyano-6-({[(4-ethylphenyl)carbamoyl]methyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-14-dihydropyridine-3-carboxamide

SMILES

CCc(cc1)ccc1NC(CSC(NC(C)=C(C1c2cccs2)C(Nc2c(C)cccc2)=O)=C1C#N)=O

InChI

InChI=1S/C29H28N4O2S2/c1-4-20-11-13-21(14-12-20)32-25(34)17-37-29-22(16-30)27(24-10-7-15-36-24)26(19(3)31-29)28(35)33-23-9-6-5-8-18(23)2/h5-15,27,31H,4,17H2,1-3H3,(H,32,34)(H,33,35)/t27-/m0/s1

InChI Key

CNOJBZYHOYFDTF-MHZLTWQESA-N

MDL Number (MFCD)

MFCD02236807

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

528.7

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.544

Distribution Coefficient, logD

4.703

Water Solubility, LogSw

-5.34

Polar Surface Area

73.392

Acid Dissociation Constant (pKa)

6.63

Base Dissociation Constant (pKb)

-5.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.70

2909-0303 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 2909-0303 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2909-0303?
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What is the minimum amount of 2909-0303 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2909-0303
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2909-0303
  • 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 2909-0303 available by request