L865-0075 Screening compound: N-[2-(1H-indol-3-yl)ethyl]-1-{7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide

L865-0075 Screening compound: N-[2-(1H-indol-3-yl)ethyl]-1-{7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide
L865-0075 Screening compound: N-[2-(1H-indol-3-yl)ethyl]-1-{7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L865-0075
N-[2-(1H-indol-3-yl)ethyl]-1-{7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-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

L865-0075

Molecular Formula

C21H22N6O2S (C21 H22 N6 O2 S)

Compound Name

N-[2-(1H-indol-3-yl)ethyl]-1-{7-oxo-6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide

IUPAC name

N-[2-(1H-indol-3-yl)ethyl]-1-{7-oxo-6H7H-[13]thiazolo[45-d]pyrimidin-2-yl}piperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1c1nc(N=CNC2=O)c2s1)NCCc1c[nH]c2c1cccc2

InChI

InChI=1S/C21H22N6O2S/c28-19(22-8-5-14-11-23-16-4-2-1-3-15(14)16)13-6-9-27(10-7-13)21-26-18-17(30-21)20(29)25-12-24-18/h1-4,11-13,23H,5-10H2,(H,22,28)(H,24,25,29)

InChI Key

VKGJTLHRLZGPHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27482457

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.008

Distribution Coefficient, logD

2.005

Water Solubility, LogSw

-2.45

Polar Surface Area

83.909

Acid Dissociation Constant (pKa)

9.58

Base Dissociation Constant (pKb)

0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L865-0075 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L865-0075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L865-0075?
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What is the minimum amount of L865-0075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L865-0075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L865-0075
  • 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 L865-0075 available by request