T636-1016 Screening compound: 4-[2-(4-PYRIDYL)-6,7-DIHYDRO-5H-CYCLOPENTA[D]PYRIMIDIN-4-YL]THIOMORPHOLINE

T636-1016 Screening compound: 4-[2-(4-PYRIDYL)-6,7-DIHYDRO-5H-CYCLOPENTA[D]PYRIMIDIN-4-YL]THIOMORPHOLINE
T636-1016 Screening compound: 4-[2-(4-PYRIDYL)-6,7-DIHYDRO-5H-CYCLOPENTA[D]PYRIMIDIN-4-YL]THIOMORPHOLINE alternative view

Chemical Structure Depiction of ChemDiv screening compound T636-1016
4-[2-(4-PYRIDYL)-6,7-DIHYDRO-5H-CYCLOPENTA[D]PYRIMIDIN-4-YL]THIOMORPHOLINE

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

T636-1016

Molecular Formula

C16H18N4S (C16 H18 N4 S)

Compound Name

4-[2-(4-PYRIDYL)-6,7-DIHYDRO-5H-CYCLOPENTA[D]PYRIMIDIN-4-YL]THIOMORPHOLINE

IUPAC name

4-[2-(pyridin-4-yl)-5H6H7H-cyclopenta[d]pyrimidin-4-yl]thiomorpholine

SMILES

C(C1)Cc2c1c(N1CCSCC1)nc(-c1ccncc1)n2

InChI

InChI=1S/C16H18N4S/c1-2-13-14(3-1)18-15(12-4-6-17-7-5-12)19-16(13)20-8-10-21-11-9-20/h4-7H,1-3,8-11H2

InChI Key

COKANGUPROEYFM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27622907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.360

Distribution Coefficient, logD

3.334

Water Solubility, LogSw

-3.45

Polar Surface Area

33.139

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.75

T636-1016 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T636-1016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T636-1016?
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What is the minimum amount of T636-1016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T636-1016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T636-1016
  • 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 T636-1016 available by request