C514-0327 Screening compound: N-(4-acetylphenyl)-1-({5-[(1E)-2-(furan-2-yl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxamide

C514-0327 Screening compound: N-(4-acetylphenyl)-1-({5-[(1E)-2-(furan-2-yl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxamide
C514-0327 Screening compound: N-(4-acetylphenyl)-1-({5-[(1E)-2-(furan-2-yl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C514-0327
N-(4-acetylphenyl)-1-({5-[(1E)-2-(furan-2-yl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)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

C514-0327

Molecular Formula

C24H25N3O6S (C24 H25 N3 O6 S)

Compound Name

N-(4-acetylphenyl)-1-({5-[(1E)-2-(furan-2-yl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxamide

IUPAC name

N-(4-acetylphenyl)-1-({5-[(1E)-2-(furan-2-yl)ethenyl]-3-methyl-12-oxazol-4-yl}sulfonyl)piperidine-4-carboxamide

SMILES

CC(c(cc1)ccc1NC(C(CC1)CCN1S(c1c(/C=C/c2ccco2)onc1C)(=O)=O)=O)=O

InChI

InChI=1S/C24H25N3O6S/c1-16-23(22(33-26-16)10-9-21-4-3-15-32-21)34(30,31)27-13-11-19(12-14-27)24(29)25-20-7-5-18(6-8-20)17(2)28/h3-10,15,19H,11-14H2,1-2H3,(H,25,29)

InChI Key

CXTUEXKJEMKHBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14763423

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.55

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.235

Distribution Coefficient, logD

2.234

Water Solubility, LogSw

-2.67

Polar Surface Area

98.132

Acid Dissociation Constant (pKa)

9.98

Base Dissociation Constant (pKb)

-1.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

C514-0327 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

GPCR Targeted Library (31838 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C514-0327 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C514-0327?
Check Price and Availability of C514-0327, 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 C514-0327 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C514-0327
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C514-0327
  • 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 C514-0327 available by request