D549-1772 Screening compound: 2-[(5-{3-aminothieno[2,3-b]pyridin-2-yl}-4-cyclopentyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide

D549-1772 Screening compound: 2-[(5-{3-aminothieno[2,3-b]pyridin-2-yl}-4-cyclopentyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide
D549-1772 Screening compound: 2-[(5-{3-aminothieno[2,3-b]pyridin-2-yl}-4-cyclopentyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D549-1772
2-[(5-{3-aminothieno[2,3-b]pyridin-2-yl}-4-cyclopentyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide

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

D549-1772

Molecular Formula

C22H22N6OS2 (C22 H22 N6 OS2)

Compound Name

2-[(5-{3-aminothieno[2,3-b]pyridin-2-yl}-4-cyclopentyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide

IUPAC name

2-[(5-{3-aminothieno[23-b]pyridin-2-yl}-4-cyclopentyl-4H-124-triazol-3-yl)sulfanyl]-N-phenylacetamide

SMILES

Nc1c(-c(n2C3CCCC3)nnc2SCC(Nc2ccccc2)=O)sc2ncccc12

InChI

InChI=1S/C22H22N6OS2/c23-18-16-11-6-12-24-21(16)31-19(18)20-26-27-22(28(20)15-9-4-5-10-15)30-13-17(29)25-14-7-2-1-3-8-14/h1-3,6-8,11-12,15H,4-5,9-10,13,23H2,(H,25,29)

InChI Key

RWWWWUMZIBZVCD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18912762

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.788

Distribution Coefficient, logD

3.786

Water Solubility, LogSw

-4.20

Polar Surface Area

77.600

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

4.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

D549-1772 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D549-1772 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D549-1772?
Check Price and Availability of D549-1772, 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 D549-1772 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D549-1772
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D549-1772
  • 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 D549-1772 available by request