D348-0089 Screening compound: N-(3-chloro-4-methoxyphenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-carboxamide

D348-0089 Screening compound: N-(3-chloro-4-methoxyphenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-carboxamide
D348-0089 Screening compound: N-(3-chloro-4-methoxyphenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D348-0089
N-(3-chloro-4-methoxyphenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-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

D348-0089

Molecular Formula

C18H19ClN2O4S (C18 H19 ClN2 O4 S)

Compound Name

N-(3-chloro-4-methoxyphenyl)-1-(ethanesulfonyl)-2,3-dihydro-1H-indole-5-carboxamide

IUPAC name

N-(3-chloro-4-methoxyphenyl)-1-(ethanesulfonyl)-23-dihydro-1H-indole-5-carboxamide

SMILES

CCS(N(CC1)c(cc2)c1cc2C(Nc(cc1)cc(Cl)c1OC)=O)(=O)=O

InChI

InChI=1S/C18H19ClN2O4S/c1-3-26(23,24)21-9-8-12-10-13(4-6-16(12)21)18(22)20-14-5-7-17(25-2)15(19)11-14/h4-7,10-11H,3,8-9H2,1-2H3,(H,20,22)

InChI Key

DEKHIKSGGUCHRE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09673645

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.156

Distribution Coefficient, logD

3.100

Water Solubility, LogSw

-3.69

Polar Surface Area

62.644

Acid Dissociation Constant (pKa)

8.27

Base Dissociation Constant (pKb)

-1.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

D348-0089 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anticancer Library (62698 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with D348-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D348-0089?
Check Price and Availability of D348-0089, 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 D348-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D348-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D348-0089
  • 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 D348-0089 available by request