K788-6355 Screening compound: N-[3-(cyclohexylsulfanyl)propyl]-2-{[4-(propan-2-yl)phenyl]amino}quinoline-4-carboxamide

K788-6355 Screening compound: N-[3-(cyclohexylsulfanyl)propyl]-2-{[4-(propan-2-yl)phenyl]amino}quinoline-4-carboxamide
K788-6355 Screening compound: N-[3-(cyclohexylsulfanyl)propyl]-2-{[4-(propan-2-yl)phenyl]amino}quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-6355
N-[3-(cyclohexylsulfanyl)propyl]-2-{[4-(propan-2-yl)phenyl]amino}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

K788-6355

Molecular Formula

C28H35N3OS (C28 H35 N3 OS)

Compound Name

N-[3-(cyclohexylsulfanyl)propyl]-2-{[4-(propan-2-yl)phenyl]amino}quinoline-4-carboxamide

IUPAC name

N-[3-(cyclohexylsulfanyl)propyl]-2-{[4-(propan-2-yl)phenyl]amino}quinoline-4-carboxamide

SMILES

CC(C)c(cc1)ccc1Nc1nc2ccccc2c(C(NCCCSC2CCCCC2)=O)c1

InChI

InChI=1S/C28H35N3OS/c1-20(2)21-13-15-22(16-14-21)30-27-19-25(24-11-6-7-12-26(24)31-27)28(32)29-17-8-18-33-23-9-4-3-5-10-23/h6-7,11-16,19-20,23H,3-5,8-10,17-18H2,1-2H3,(H,29,32)(H,30,31)

InChI Key

SKTMIFSGCIRTEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15106403

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.67

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

7.719

Distribution Coefficient, logD

7.718

Water Solubility, LogSw

-5.83

Polar Surface Area

42.496

Acid Dissociation Constant (pKa)

16.08

Base Dissociation Constant (pKb)

4.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

K788-6355 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with K788-6355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-6355?
Check Price and Availability of K788-6355, 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 K788-6355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-6355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-6355
  • 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 K788-6355 available by request