K788-1652 Screening compound: 3-cyclohexyl-1-(4-ethoxyphenyl)-3-[1-(pyridin-3-yl)ethyl]urea

K788-1652 Screening compound: 3-cyclohexyl-1-(4-ethoxyphenyl)-3-[1-(pyridin-3-yl)ethyl]urea
K788-1652 Screening compound: 3-cyclohexyl-1-(4-ethoxyphenyl)-3-[1-(pyridin-3-yl)ethyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-1652
3-cyclohexyl-1-(4-ethoxyphenyl)-3-[1-(pyridin-3-yl)ethyl]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

K788-1652

Molecular Formula

C22H29N3O2 (C22 H29 N3 O2)

Compound Name

3-cyclohexyl-1-(4-ethoxyphenyl)-3-[1-(pyridin-3-yl)ethyl]urea

IUPAC name

3-cyclohexyl-1-(4-ethoxyphenyl)-3-[1-(pyridin-3-yl)ethyl]urea

SMILES

CCOc(cc1)ccc1NC(N(C(C)c1cnccc1)C1CCCCC1)=O

InChI

InChI=1S/C22H29N3O2/c1-3-27-21-13-11-19(12-14-21)24-22(26)25(20-9-5-4-6-10-20)17(2)18-8-7-15-23-16-18/h7-8,11-17,20H,3-6,9-10H2,1-2H3,(H,24,26)/t17-/m0/s1

InChI Key

GKWRVFCTPGKYJC-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD15103291

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.563

Distribution Coefficient, logD

4.563

Water Solubility, LogSw

-3.90

Polar Surface Area

40.357

Acid Dissociation Constant (pKa)

14.95

Base Dissociation Constant (pKb)

3.92

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

K788-1652 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antifungal Library (16415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K788-1652 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-1652?
Check Price and Availability of K788-1652, 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 K788-1652 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-1652
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-1652
  • 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 K788-1652 available by request