C528-1177 Screening compound: 2-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}-N-[2-(pyrrolidin-1-yl)ethyl]acetamide

C528-1177 Screening compound: 2-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}-N-[2-(pyrrolidin-1-yl)ethyl]acetamide
C528-1177 Screening compound: 2-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}-N-[2-(pyrrolidin-1-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C528-1177
2-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}-N-[2-(pyrrolidin-1-yl)ethyl]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

C528-1177

Molecular Formula

C20H27N3O4S (C20 H27 N3 O4 S)

Compound Name

2-{[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}-N-[2-(pyrrolidin-1-yl)ethyl]acetamide

IUPAC name

n/a

SMILES

Cc1c(CS(CC(NCCN2CCCC2)=O)(=O)=O)nc(-c2c(C)cccc2)o1

InChI

InChI=1S/C20H27N3O4S/c1-15-7-3-4-8-17(15)20-22-18(16(2)27-20)13-28(25,26)14-19(24)21-9-12-23-10-5-6-11-23/h3-4,7-8H,5-6,9-14H2,1-2H3,(H,21,24)

InChI Key

YOIAXVMLPFYQQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14767169

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.52

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.280

Distribution Coefficient, logD

-0.486

Water Solubility, LogSw

-2.20

Polar Surface Area

75.051

Acid Dissociation Constant (pKa)

13.58

Base Dissociation Constant (pKb)

9.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C528-1177 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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 C528-1177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C528-1177?
Check Price and Availability of C528-1177, 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 C528-1177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C528-1177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C528-1177
  • 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 C528-1177 available by request