G877-0018 Screening compound: 2-[(1-cyclopentyl-1H-imidazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide

G877-0018 Screening compound: 2-[(1-cyclopentyl-1H-imidazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
G877-0018 Screening compound: 2-[(1-cyclopentyl-1H-imidazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G877-0018
2-[(1-cyclopentyl-1H-imidazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide

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

G877-0018

Molecular Formula

C17H21N3O2S (C17 H21 N3 O2 S)

Compound Name

2-[(1-cyclopentyl-1H-imidazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide

IUPAC name

2-[(1-cyclopentyl-1H-imidazol-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide

SMILES

COc1cccc(NC(CSc2nccn2C2CCCC2)=O)c1

InChI

InChI=1S/C17H21N3O2S/c1-22-15-8-4-5-13(11-15)19-16(21)12-23-17-18-9-10-20(17)14-6-2-3-7-14/h4-5,8-11,14H,2-3,6-7,12H2,1H3,(H,19,21)

InChI Key

BPAYUWDARSWWSU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09239169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.248

Distribution Coefficient, logD

3.244

Water Solubility, LogSw

-3.55

Polar Surface Area

43.410

Acid Dissociation Constant (pKa)

11.85

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

G877-0018 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G877-0018 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G877-0018?
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What is the minimum amount of G877-0018 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G877-0018
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G877-0018
  • 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 G877-0018 available by request