T387-1037 Screening compound: 1-methyl-4-{1-[5-(thiophen-3-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-4-carbonyl}piperazine

T387-1037 Screening compound: 1-methyl-4-{1-[5-(thiophen-3-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-4-carbonyl}piperazine
T387-1037 Screening compound: 1-methyl-4-{1-[5-(thiophen-3-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-4-carbonyl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound T387-1037
1-methyl-4-{1-[5-(thiophen-3-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-4-carbonyl}piperazine

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

T387-1037

Molecular Formula

C21H25N5OS2 (C21 H25 N5 OS2)

Compound Name

1-methyl-4-{1-[5-(thiophen-3-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]piperidine-4-carbonyl}piperazine

IUPAC name

1-methyl-4-{1-[5-(thiophen-3-yl)-[13]thiazolo[54-b]pyridin-2-yl]piperidine-4-carbonyl}piperazine

SMILES

CN(CC1)CCN1C(C(CC1)CCN1c1nc2ccc(-c3cscc3)nc2s1)=O

InChI

InChI=1S/C21H25N5OS2/c1-24-9-11-25(12-10-24)20(27)15-4-7-26(8-5-15)21-23-18-3-2-17(22-19(18)29-21)16-6-13-28-14-16/h2-3,6,13-15H,4-5,7-12H2,1H3

InChI Key

YTTHQZKLLARLTO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27619184

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.481

Distribution Coefficient, logD

3.133

Water Solubility, LogSw

-3.46

Polar Surface Area

43.072

Acid Dissociation Constant (pKa)

20.97

Base Dissociation Constant (pKb)

7.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

T387-1037 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T387-1037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T387-1037?
Check Price and Availability of T387-1037, 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 T387-1037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T387-1037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T387-1037
  • 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 T387-1037 available by request