P090-0239 Screening compound: 3-(1-ethyl-1H-indol-4-yl)-N-(tetrahydro-2-furanylmethyl)propanamide

P090-0239 Screening compound: 3-(1-ethyl-1H-indol-4-yl)-N-(tetrahydro-2-furanylmethyl)propanamide
P090-0239 Screening compound: 3-(1-ethyl-1H-indol-4-yl)-N-(tetrahydro-2-furanylmethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P090-0239
3-(1-ethyl-1H-indol-4-yl)-N-(tetrahydro-2-furanylmethyl)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

P090-0239

Molecular Formula

C18H24N2O2 (C18 H24 N2 O2)

Compound Name

3-(1-ethyl-1H-indol-4-yl)-N-(tetrahydro-2-furanylmethyl)propanamide

IUPAC name

3-(1-ethyl-1H-indol-4-yl)-N-[(oxolan-2-yl)methyl]propanamide

SMILES

CCn1c2cccc(CCC(NCC3OCCC3)=O)c2cc1

InChI

InChI=1S/C18H24N2O2/c1-2-20-11-10-16-14(5-3-7-17(16)20)8-9-18(21)19-13-15-6-4-12-22-15/h3,5,7,10-11,15H,2,4,6,8-9,12-13H2,1H3,(H,19,21)/t15-/m1/s1

InChI Key

QUOYLKKRVVFAJG-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD27563677

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.019

Distribution Coefficient, logD

2.019

Water Solubility, LogSw

-2.29

Polar Surface Area

34.928

Acid Dissociation Constant (pKa)

13.66

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

P090-0239 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Indole Derivatives (10091 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P090-0239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P090-0239?
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What is the minimum amount of P090-0239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P090-0239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P090-0239
  • 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 P090-0239 available by request