4478-6575 Screening compound: 3-phenyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]propanamide

4478-6575 Screening compound: 3-phenyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]propanamide
4478-6575 Screening compound: 3-phenyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4478-6575
3-phenyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]propanamide

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

4478-6575

Molecular Formula

C19H22N2O3S (C19 H22 N2 O3 S)

Compound Name

3-phenyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]propanamide

IUPAC name

3-phenyl-N-[4-(pyrrolidine-1-sulfonyl)phenyl]propanamide

SMILES

O=C(CCc1ccccc1)Nc(cc1)ccc1S(N1CCCC1)(=O)=O

InChI

InChI=1S/C19H22N2O3S/c22-19(13-8-16-6-2-1-3-7-16)20-17-9-11-18(12-10-17)25(23,24)21-14-4-5-15-21/h1-3,6-7,9-12H,4-5,8,13-15H2,(H,20,22)

InChI Key

ONUXHCBIHREYCA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01971547

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

358.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.164

Distribution Coefficient, logD

3.161

Water Solubility, LogSw

-3.61

Polar Surface Area

55.193

Acid Dissociation Constant (pKa)

9.67

Base Dissociation Constant (pKb)

-1.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

4478-6575 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4478-6575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4478-6575?
Check Price and Availability of 4478-6575, 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 4478-6575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4478-6575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4478-6575
  • 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 4478-6575 available by request