T508-0177 Screening compound: 7-phenyl-8-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1,2,3,5-tetrahydroindolizin-5-one

T508-0177 Screening compound: 7-phenyl-8-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1,2,3,5-tetrahydroindolizin-5-one
T508-0177 Screening compound: 7-phenyl-8-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1,2,3,5-tetrahydroindolizin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T508-0177
7-phenyl-8-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1,2,3,5-tetrahydroindolizin-5-one

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

T508-0177

Molecular Formula

C23H23N5O2 (C23 H23 N5 O2)

Compound Name

7-phenyl-8-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1,2,3,5-tetrahydroindolizin-5-one

IUPAC name

7-phenyl-8-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1235-tetrahydroindolizin-5-one

SMILES

O=C(C(C(c1ccccc1)=C1)=C(CCC2)N2C1=O)N(CC1)CCN1c1ncccn1

InChI

InChI=1S/C23H23N5O2/c29-20-16-18(17-6-2-1-3-7-17)21(19-8-4-11-28(19)20)22(30)26-12-14-27(15-13-26)23-24-9-5-10-25-23/h1-3,5-7,9-10,16H,4,8,11-15H2

InChI Key

DSJGOBGFMXYVMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31984453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.188

Distribution Coefficient, logD

2.188

Water Solubility, LogSw

-2.18

Polar Surface Area

55.365

Acid Dissociation Constant (pKa)

21.15

Base Dissociation Constant (pKb)

2.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.43

T508-0177 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 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 T508-0177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T508-0177?
Check Price and Availability of T508-0177, 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 T508-0177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T508-0177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T508-0177
  • 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 T508-0177 available by request