5350-0197 Screening compound: 3-amino-6-(4-methoxyphenyl)-N-{[4-(trifluoromethyl)phenyl]methyl}thieno[2,3-b]pyridine-2-carboxamide

5350-0197 Screening compound: 3-amino-6-(4-methoxyphenyl)-N-{[4-(trifluoromethyl)phenyl]methyl}thieno[2,3-b]pyridine-2-carboxamide
5350-0197 Screening compound: 3-amino-6-(4-methoxyphenyl)-N-{[4-(trifluoromethyl)phenyl]methyl}thieno[2,3-b]pyridine-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5350-0197
3-amino-6-(4-methoxyphenyl)-N-{[4-(trifluoromethyl)phenyl]methyl}thieno[2,3-b]pyridine-2-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

5350-0197

Molecular Formula

C23H18F3N3O2S (C23 H18 F3 N3 O2 S)

Compound Name

3-amino-6-(4-methoxyphenyl)-N-{[4-(trifluoromethyl)phenyl]methyl}thieno[2,3-b]pyridine-2-carboxamide

IUPAC name

3-amino-6-(4-methoxyphenyl)-N-{[4-(trifluoromethyl)phenyl]methyl}thieno[23-b]pyridine-2-carboxamide

SMILES

COc(cc1)ccc1-c1ccc(c(N)c(C(NCc2ccc(C(F)(F)F)cc2)=O)s2)c2n1

InChI

InChI=1S/C23H18F3N3O2S/c1-31-16-8-4-14(5-9-16)18-11-10-17-19(27)20(32-22(17)29-18)21(30)28-12-13-2-6-15(7-3-13)23(24,25)26/h2-11H,12,27H2,1H3,(H,28,30)

InChI Key

XXJNNDGQXHZGPK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03234397

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.696

Distribution Coefficient, logD

5.690

Water Solubility, LogSw

-5.67

Polar Surface Area

61.031

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

5.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

5350-0197 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CNS Targets (44014 compounds)

CORONAVIRUS Library (20774 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 5350-0197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5350-0197?
Check Price and Availability of 5350-0197, 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 5350-0197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5350-0197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5350-0197
  • 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 5350-0197 available by request