G008-2647 Screening compound: 2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-N-({1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl}methyl)benzene-1-sulfonamide

G008-2647 Screening compound: 2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-N-({1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl}methyl)benzene-1-sulfonamide
G008-2647 Screening compound: 2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-N-({1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl}methyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G008-2647
2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-N-({1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl}methyl)benzene-1-sulfonamide

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

G008-2647

Molecular Formula

C23H29N3O3S2 (C23 H29 N3 O3 S2)

Compound Name

2-methyl-5-(3-methyl-1,2-oxazol-5-yl)-N-({1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl}methyl)benzene-1-sulfonamide

IUPAC name

2-methyl-5-(3-methyl-12-oxazol-5-yl)-N-({1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl}methyl)benzene-1-sulfonamide

SMILES

Cc1noc(-c2cc(S(NCC3CCN(CCc4cccs4)CC3)(=O)=O)c(C)cc2)c1

InChI

InChI=1S/C23H29N3O3S2/c1-17-5-6-20(22-14-18(2)25-29-22)15-23(17)31(27,28)24-16-19-7-10-26(11-8-19)12-9-21-4-3-13-30-21/h3-6,13-15,19,24H,7-12,16H2,1-2H3

InChI Key

TZWSXKMOTBRLAB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14975443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.768

Distribution Coefficient, logD

3.229

Water Solubility, LogSw

-4.43

Polar Surface Area

68.068

Acid Dissociation Constant (pKa)

10.79

Base Dissociation Constant (pKb)

8.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

G008-2647 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G008-2647 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G008-2647?
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What is the minimum amount of G008-2647 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G008-2647
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G008-2647
  • 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 G008-2647 available by request