D391-0457 Screening compound: N-[(1H-indol-3-yl)(phenyl)methyl]-N,2-dimethylpropanamide

D391-0457 Screening compound: N-[(1H-indol-3-yl)(phenyl)methyl]-N,2-dimethylpropanamide
D391-0457 Screening compound: N-[(1H-indol-3-yl)(phenyl)methyl]-N,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D391-0457
N-[(1H-indol-3-yl)(phenyl)methyl]-N,2-dimethylpropanamide

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

D391-0457

Molecular Formula

C20H22N2O (C20 H22 N2 O)

Compound Name

N-[(1H-indol-3-yl)(phenyl)methyl]-N,2-dimethylpropanamide

IUPAC name

N-[(1H-indol-3-yl)(phenyl)methyl]-N2-dimethylpropanamide

SMILES

CC(C)C(N(C)C(c1c[nH]c2c1cccc2)c1ccccc1)=O

InChI

InChI=1S/C20H22N2O/c1-14(2)20(23)22(3)19(15-9-5-4-6-10-15)17-13-21-18-12-8-7-11-16(17)18/h4-14,19,21H,1-3H3/t19-/m1/s1

InChI Key

FNNOWYKYJIUIGI-LJQANCHMSA-N

MDL Number (MFCD)

MFCD12918029

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.41

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.229

Distribution Coefficient, logD

4.229

Water Solubility, LogSw

-4.20

Polar Surface Area

25.051

Acid Dissociation Constant (pKa)

18.22

Base Dissociation Constant (pKb)

-1.53

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

D391-0457 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D391-0457 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D391-0457?
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What is the minimum amount of D391-0457 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D391-0457
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D391-0457
  • 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 D391-0457 available by request