D399-0626 Screening compound: N-(4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]sulfonyl}phenyl)acetamide

D399-0626 Screening compound: N-(4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]sulfonyl}phenyl)acetamide
D399-0626 Screening compound: N-(4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]sulfonyl}phenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D399-0626
N-(4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]sulfonyl}phenyl)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

D399-0626

Molecular Formula

C18H19FN2O3S (C18 H19 FN2 O3 S)

Compound Name

N-(4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]sulfonyl}phenyl)acetamide

IUPAC name

N-(4-{[2-(4-fluorophenyl)pyrrolidin-1-yl]sulfonyl}phenyl)acetamide

SMILES

CC(Nc(cc1)ccc1S(N(CCC1)C1c(cc1)ccc1F)(=O)=O)=O

InChI

InChI=1S/C18H19FN2O3S/c1-13(22)20-16-8-10-17(11-9-16)25(23,24)21-12-2-3-18(21)14-4-6-15(19)7-5-14/h4-11,18H,2-3,12H2,1H3,(H,20,22)/t18-/m0/s1

InChI Key

XRIOLYOVDZFAKS-SFHVURJKSA-N

MDL Number (MFCD)

MFCD10702840

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.541

Distribution Coefficient, logD

2.541

Water Solubility, LogSw

-2.89

Polar Surface Area

55.777

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

-1.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.80

D399-0626 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Integrin Receptors Targeted library (1715 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
  • Cancer
Mechanism of action:
  • Epigenetic
  • PPI modulators
Targets:
  • Others

References: we are preparing a list of scientific research reports with D399-0626 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D399-0626?
Check Price and Availability of D399-0626, 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 D399-0626 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D399-0626
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D399-0626
  • 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 D399-0626 available by request