K788-1318 Screening compound: N-cyclopentyl-6-[(4-methylpiperidin-1-yl)sulfonyl]-2-(pyridin-3-yl)quinoline-4-carboxamide

K788-1318 Screening compound: N-cyclopentyl-6-[(4-methylpiperidin-1-yl)sulfonyl]-2-(pyridin-3-yl)quinoline-4-carboxamide
K788-1318 Screening compound: N-cyclopentyl-6-[(4-methylpiperidin-1-yl)sulfonyl]-2-(pyridin-3-yl)quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-1318
N-cyclopentyl-6-[(4-methylpiperidin-1-yl)sulfonyl]-2-(pyridin-3-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

K788-1318

Molecular Formula

C26H30N4O3S (C26 H30 N4 O3 S)

Compound Name

N-cyclopentyl-6-[(4-methylpiperidin-1-yl)sulfonyl]-2-(pyridin-3-yl)quinoline-4-carboxamide

IUPAC name

N-cyclopentyl-6-[(4-methylpiperidin-1-yl)sulfonyl]-2-(pyridin-3-yl)quinoline-4-carboxamide

SMILES

CC(CC1)CCN1S(c(ccc1nc(-c2cnccc2)c2)cc1c2C(NC1CCCC1)=O)(=O)=O

InChI

InChI=1S/C26H30N4O3S/c1-18-10-13-30(14-11-18)34(32,33)21-8-9-24-22(15-21)23(26(31)28-20-6-2-3-7-20)16-25(29-24)19-5-4-12-27-17-19/h4-5,8-9,12,15-18,20H,2-3,6-7,10-11,13-14H2,1H3,(H,28,31)

InChI Key

DUBOMFICFOVVCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15103041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.754

Distribution Coefficient, logD

4.753

Water Solubility, LogSw

-4.25

Polar Surface Area

74.031

Acid Dissociation Constant (pKa)

16.52

Base Dissociation Constant (pKb)

4.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

K788-1318 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anticancer Library (62698 compounds)

Antiviral Library (67538 compounds)

Autophagy-Targeted Library (4564 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with K788-1318 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-1318?
Check Price and Availability of K788-1318, 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 K788-1318 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-1318
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-1318
  • 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 K788-1318 available by request