K786-3752 Screening compound: N-(2,3-dimethylcyclohexyl)-6-(morpholine-4-sulfonyl)-2-(pyridin-2-yl)quinoline-4-carboxamide

K786-3752 Screening compound: N-(2,3-dimethylcyclohexyl)-6-(morpholine-4-sulfonyl)-2-(pyridin-2-yl)quinoline-4-carboxamide
K786-3752 Screening compound: N-(2,3-dimethylcyclohexyl)-6-(morpholine-4-sulfonyl)-2-(pyridin-2-yl)quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K786-3752
N-(2,3-dimethylcyclohexyl)-6-(morpholine-4-sulfonyl)-2-(pyridin-2-yl)quinoline-4-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

K786-3752

Molecular Formula

C27H32N4O4S (C27 H32 N4 O4 S)

Compound Name

N-(2,3-dimethylcyclohexyl)-6-(morpholine-4-sulfonyl)-2-(pyridin-2-yl)quinoline-4-carboxamide

IUPAC name

N-(23-dimethylcyclohexyl)-6-(morpholine-4-sulfonyl)-2-(pyridin-2-yl)quinoline-4-carboxamide

SMILES

CC(CCC1)C(C)C1NC(c1c(cc(cc2)S(N3CCOCC3)(=O)=O)c2nc(-c2ncccc2)c1)=O

InChI

InChI=1S/C27H32N4O4S/c1-18-6-5-8-23(19(18)2)30-27(32)22-17-26(25-7-3-4-11-28-25)29-24-10-9-20(16-21(22)24)36(33,34)31-12-14-35-15-13-31/h3-4,7,9-11,16-19,23H,5-6,8,12-15H2,1-2H3,(H,30,32)

InChI Key

ALGPGXKXPBCLLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15100916

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.64

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.058

Distribution Coefficient, logD

4.057

Water Solubility, LogSw

-4.01

Polar Surface Area

81.494

Acid Dissociation Constant (pKa)

15.51

Base Dissociation Constant (pKb)

3.15

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

44.40

K786-3752 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

GABA Library (7115 compounds)

GPCR Targeted Library (31838 compounds)

Purinergic Library (3321 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Eye
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Cardiovascular
  • Metabolic
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • GPCR
  • Ion Channels
  • GPCR
  • GPCR
  • Ion Channels
  • Phosphatases
Mechanism of action:
  • Receptor's ligands
  • Receptor's ligands
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with K786-3752 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K786-3752?
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What is the minimum amount of K786-3752 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K786-3752
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K786-3752
  • 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 K786-3752 available by request