D256-0080 Screening compound: N-(5-chloro-2-methoxyphenyl)-1-methanesulfonyl-2,3-dihydro-1H-indole-5-carboxamide

D256-0080 Screening compound: N-(5-chloro-2-methoxyphenyl)-1-methanesulfonyl-2,3-dihydro-1H-indole-5-carboxamide
D256-0080 Screening compound: N-(5-chloro-2-methoxyphenyl)-1-methanesulfonyl-2,3-dihydro-1H-indole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D256-0080
N-(5-chloro-2-methoxyphenyl)-1-methanesulfonyl-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

D256-0080

Molecular Formula

C17H17ClN2O4S (C17 H17 ClN2 O4 S)

Compound Name

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

IUPAC name

N-(5-chloro-2-methoxyphenyl)-1-methanesulfonyl-23-dihydro-1H-indole-5-carboxamide

SMILES

COc(ccc(Cl)c1)c1NC(c(cc1)cc(CC2)c1N2S(C)(=O)=O)=O

InChI

InChI=1S/C17H17ClN2O4S/c1-24-16-6-4-13(18)10-14(16)19-17(21)12-3-5-15-11(9-12)7-8-20(15)25(2,22)23/h3-6,9-10H,7-8H2,1-2H3,(H,19,21)

InChI Key

DTKXJETYVLTLRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09159134

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.85

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.776

Distribution Coefficient, logD

2.331

Water Solubility, LogSw

-3.71

Polar Surface Area

61.545

Acid Dissociation Constant (pKa)

7.15

Base Dissociation Constant (pKb)

-1.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D256-0080 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Cardiovascular Library (22201 compounds)

Nucleic Acid Ligands (8311 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with D256-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D256-0080?
Check Price and Availability of D256-0080, 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 D256-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D256-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D256-0080
  • 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 D256-0080 available by request