G336-0486 Screening compound: N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]-4-OXO-4-(4-{[1,3]THIAZOLO[5,4-B]PYRIDIN-2-YL}PIPERAZIN-1-YL)BUTANAMIDE

G336-0486 Screening compound: N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]-4-OXO-4-(4-{[1,3]THIAZOLO[5,4-B]PYRIDIN-2-YL}PIPERAZIN-1-YL)BUTANAMIDE
G336-0486 Screening compound: N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]-4-OXO-4-(4-{[1,3]THIAZOLO[5,4-B]PYRIDIN-2-YL}PIPERAZIN-1-YL)BUTANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound G336-0486
N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]-4-OXO-4-(4-{[1,3]THIAZOLO[5,4-B]PYRIDIN-2-YL}PIPERAZIN-1-YL)BUTANAMIDE

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

G336-0486

Molecular Formula

C24H25ClN6O2S (C24 H25 ClN6 O2 S)

Compound Name

N-[2-(5-CHLORO-1H-INDOL-3-YL)ETHYL]-4-OXO-4-(4-{[1,3]THIAZOLO[5,4-B]PYRIDIN-2-YL}PIPERAZIN-1-YL)BUTANAMIDE

IUPAC name

n/a

SMILES

O=C(CCC(N(CC1)CCN1c1nc(cccn2)c2s1)=O)NCCc1c[nH]c(cc2)c1cc2Cl

InChI

InChI=1S/C24H25ClN6O2S/c25-17-3-4-19-18(14-17)16(15-28-19)7-9-26-21(32)5-6-22(33)30-10-12-31(13-11-30)24-29-20-2-1-8-27-23(20)34-24/h1-4,8,14-15,28H,5-7,9-13H2,(H,26,32)

InChI Key

KLXXJAVZNLEIED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27135855

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.02

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.695

Distribution Coefficient, logD

2.695

Water Solubility, LogSw

-3.52

Polar Surface Area

72.745

Acid Dissociation Constant (pKa)

14.24

Base Dissociation Constant (pKb)

8.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G336-0486 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G336-0486 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G336-0486?
Check Price and Availability of G336-0486, 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 G336-0486 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G336-0486
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G336-0486
  • 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 G336-0486 available by request