D256-0830 Screening compound: N-(2-benzoyl-4-chlorophenyl)-1-methanesulfonyl-1,2,3,4-tetrahydroquinoline-6-carboxamide

D256-0830 Screening compound: N-(2-benzoyl-4-chlorophenyl)-1-methanesulfonyl-1,2,3,4-tetrahydroquinoline-6-carboxamide
D256-0830 Screening compound: N-(2-benzoyl-4-chlorophenyl)-1-methanesulfonyl-1,2,3,4-tetrahydroquinoline-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D256-0830
N-(2-benzoyl-4-chlorophenyl)-1-methanesulfonyl-1,2,3,4-tetrahydroquinoline-6-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

D256-0830

Molecular Formula

C24H21ClN2O4S (C24 H21 ClN2 O4 S)

Compound Name

N-(2-benzoyl-4-chlorophenyl)-1-methanesulfonyl-1,2,3,4-tetrahydroquinoline-6-carboxamide

IUPAC name

N-(2-benzoyl-4-chlorophenyl)-1-methanesulfonyl-1234-tetrahydroquinoline-6-carboxamide

SMILES

CS(N(CCC1)c(cc2)c1cc2C(Nc(ccc(Cl)c1)c1C(c1ccccc1)=O)=O)(=O)=O

InChI

InChI=1S/C24H21ClN2O4S/c1-32(30,31)27-13-5-8-17-14-18(9-12-22(17)27)24(29)26-21-11-10-19(25)15-20(21)23(28)16-6-3-2-4-7-16/h2-4,6-7,9-12,14-15H,5,8,13H2,1H3,(H,26,29)

InChI Key

LCRCQZYIROPBFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09670307

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.96

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.090

Distribution Coefficient, logD

3.590

Water Solubility, LogSw

-4.53

Polar Surface Area

67.015

Acid Dissociation Constant (pKa)

7.06

Base Dissociation Constant (pKb)

-4.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

D256-0830 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Nucleic Acid Ligands (8311 compounds)

Protein-Protein Interaction Library (218420 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • PPI modulators
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with D256-0830 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D256-0830?
Check Price and Availability of D256-0830, 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 D256-0830 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D256-0830
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D256-0830
  • 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 D256-0830 available by request