D391-1049 Screening compound: N-[(1H-indol-3-yl)(thiophen-2-yl)methyl]-N,2-dimethylpropanamide

D391-1049 Screening compound: N-[(1H-indol-3-yl)(thiophen-2-yl)methyl]-N,2-dimethylpropanamide
D391-1049 Screening compound: N-[(1H-indol-3-yl)(thiophen-2-yl)methyl]-N,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D391-1049
N-[(1H-indol-3-yl)(thiophen-2-yl)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

D391-1049

Molecular Formula

C18H20N2OS (C18 H20 N2 OS)

Compound Name

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

IUPAC name

N-[(1H-indol-3-yl)(thiophen-2-yl)methyl]-N2-dimethylpropanamide

SMILES

CC(C)C(N(C)C(c1c[nH]c2c1cccc2)c1cccs1)=O

InChI

InChI=1S/C18H20N2OS/c1-12(2)18(21)20(3)17(16-9-6-10-22-16)14-11-19-15-8-5-4-7-13(14)15/h4-12,17,19H,1-3H3/t17-/m0/s1

InChI Key

MQABNDKLHCRMMY-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD12919110

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.44

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

3.849

Distribution Coefficient, logD

3.849

Water Solubility, LogSw

-4.05

Polar Surface Area

26.069

Acid Dissociation Constant (pKa)

18.39

Base Dissociation Constant (pKb)

-1.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.80

D391-1049 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D391-1049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D391-1049?
Check Price and Availability of D391-1049, 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 D391-1049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D391-1049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D391-1049
  • 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 D391-1049 available by request