K788-4740 Screening compound: 3-(1-acetylpiperidin-4-yl)-3-butyl-1-(4-ethoxyphenyl)urea

K788-4740 Screening compound: 3-(1-acetylpiperidin-4-yl)-3-butyl-1-(4-ethoxyphenyl)urea
K788-4740 Screening compound: 3-(1-acetylpiperidin-4-yl)-3-butyl-1-(4-ethoxyphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-4740
3-(1-acetylpiperidin-4-yl)-3-butyl-1-(4-ethoxyphenyl)urea

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

K788-4740

Molecular Formula

C20H31N3O3 (C20 H31 N3 O3)

Compound Name

3-(1-acetylpiperidin-4-yl)-3-butyl-1-(4-ethoxyphenyl)urea

IUPAC name

3-(1-acetylpiperidin-4-yl)-3-butyl-1-(4-ethoxyphenyl)urea

SMILES

CCCCN(C(CC1)CCN1C(C)=O)C(Nc(cc1)ccc1OCC)=O

InChI

InChI=1S/C20H31N3O3/c1-4-6-13-23(18-11-14-22(15-12-18)16(3)24)20(25)21-17-7-9-19(10-8-17)26-5-2/h7-10,18H,4-6,11-15H2,1-3H3,(H,21,25)

InChI Key

PIFBXXKMSONJTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15105177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.559

Distribution Coefficient, logD

3.559

Water Solubility, LogSw

-3.42

Polar Surface Area

48.813

Acid Dissociation Constant (pKa)

14.15

Base Dissociation Constant (pKb)

0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

K788-4740 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with K788-4740 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-4740?
Check Price and Availability of K788-4740, 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 K788-4740 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-4740
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-4740
  • 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 K788-4740 available by request