D399-3518 Screening compound: 2-(3-fluorophenyl)-N-(4-methylphenyl)pyrrolidine-1-carboxamide

D399-3518 Screening compound: 2-(3-fluorophenyl)-N-(4-methylphenyl)pyrrolidine-1-carboxamide
D399-3518 Screening compound: 2-(3-fluorophenyl)-N-(4-methylphenyl)pyrrolidine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D399-3518
2-(3-fluorophenyl)-N-(4-methylphenyl)pyrrolidine-1-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

D399-3518

Molecular Formula

C18H19FN2O (C18 H19 FN2 O)

Compound Name

2-(3-fluorophenyl)-N-(4-methylphenyl)pyrrolidine-1-carboxamide

IUPAC name

2-(3-fluorophenyl)-N-(4-methylphenyl)pyrrolidine-1-carboxamide

SMILES

Cc(cc1)ccc1NC(N(CCC1)C1c1cccc(F)c1)=O

InChI

InChI=1S/C18H19FN2O/c1-13-7-9-16(10-8-13)20-18(22)21-11-3-6-17(21)14-4-2-5-15(19)12-14/h2,4-5,7-10,12,17H,3,6,11H2,1H3,(H,20,22)/t17-/m0/s1

InChI Key

SMNBIUKCQGXFLY-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD10702554

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.36

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.949

Distribution Coefficient, logD

3.949

Water Solubility, LogSw

-3.84

Polar Surface Area

25.496

Acid Dissociation Constant (pKa)

14.59

Base Dissociation Constant (pKb)

-1.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.80

D399-3518 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
  • PPI modulators
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D399-3518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D399-3518?
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What is the minimum amount of D399-3518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D399-3518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D399-3518
  • 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 D399-3518 available by request