E140-0019 Screening compound: 2-({6-benzyl-4-oxo-3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl}sulfanyl)-N-(3,4-dimethylphenyl)acetamide

E140-0019 Screening compound: 2-({6-benzyl-4-oxo-3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl}sulfanyl)-N-(3,4-dimethylphenyl)acetamide
E140-0019 Screening compound: 2-({6-benzyl-4-oxo-3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl}sulfanyl)-N-(3,4-dimethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E140-0019
2-({6-benzyl-4-oxo-3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl}sulfanyl)-N-(3,4-dimethylphenyl)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

E140-0019

Molecular Formula

C24H26N4O2S (C24 H26 N4 O2 S)

Compound Name

2-({6-benzyl-4-oxo-3H,4H,5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-yl}sulfanyl)-N-(3,4-dimethylphenyl)acetamide

IUPAC name

2-({6-benzyl-4-oxo-3H4H5H6H7H8H-pyrido[43-d]pyrimidin-2-yl}sulfanyl)-N-(34-dimethylphenyl)acetamide

SMILES

Cc(cc1)c(C)cc1NC(CSC(N1)=NC(CCN(Cc2ccccc2)C2)=C2C1=O)=O

InChI

InChI=1S/C24H26N4O2S/c1-16-8-9-19(12-17(16)2)25-22(29)15-31-24-26-21-10-11-28(14-20(21)23(30)27-24)13-18-6-4-3-5-7-18/h3-9,12H,10-11,13-15H2,1-2H3,(H,25,29)(H,26,27,30)

InChI Key

TWKRCDCWEDGUJJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08541033

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.521

Distribution Coefficient, logD

2.971

Water Solubility, LogSw

-3.74

Polar Surface Area

61.095

Acid Dissociation Constant (pKa)

6.99

Base Dissociation Constant (pKb)

4.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

E140-0019 in Drug Discovery

Included in Screening Libraries

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with E140-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E140-0019?
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What is the minimum amount of E140-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E140-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E140-0019
  • 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 E140-0019 available by request