P091-0486 Screening compound: N-[(4-fluorophenyl)methyl]-3-(1H-indol-5-yl)propanamide

P091-0486 Screening compound: N-[(4-fluorophenyl)methyl]-3-(1H-indol-5-yl)propanamide
P091-0486 Screening compound: N-[(4-fluorophenyl)methyl]-3-(1H-indol-5-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P091-0486
N-[(4-fluorophenyl)methyl]-3-(1H-indol-5-yl)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

P091-0486

Molecular Formula

C18H17FN2O (C18 H17 FN2 O)

Compound Name

N-[(4-fluorophenyl)methyl]-3-(1H-indol-5-yl)propanamide

IUPAC name

N-[(4-fluorophenyl)methyl]-3-(1H-indol-5-yl)propanamide

SMILES

O=C(CCc(cc1)cc2c1[nH]cc2)NCc(cc1)ccc1F

InChI

InChI=1S/C18H17FN2O/c19-16-5-1-14(2-6-16)12-21-18(22)8-4-13-3-7-17-15(11-13)9-10-20-17/h1-3,5-7,9-11,20H,4,8,12H2,(H,21,22)

InChI Key

WQDZXYMFXLUCBU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27563850

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.34

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.163

Distribution Coefficient, logD

3.163

Water Solubility, LogSw

-3.30

Polar Surface Area

34.219

Acid Dissociation Constant (pKa)

12.18

Base Dissociation Constant (pKb)

-2.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

P091-0486 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Indole Derivatives (10091 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P091-0486 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P091-0486?
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What is the minimum amount of P091-0486 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P091-0486
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P091-0486
  • 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 P091-0486 available by request