1682-3724 Screening compound: 1-cyclohexyl-3-[2-(trifluoromethyl)phenyl]urea

1682-3724 Screening compound: 1-cyclohexyl-3-[2-(trifluoromethyl)phenyl]urea
1682-3724 Screening compound: 1-cyclohexyl-3-[2-(trifluoromethyl)phenyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-3724
1-cyclohexyl-3-[2-(trifluoromethyl)phenyl]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

1682-3724

Molecular Formula

C14H17F3N2O (C14 H17 F3 N2 O)

Compound Name

1-cyclohexyl-3-[2-(trifluoromethyl)phenyl]urea

IUPAC name

1-cyclohexyl-3-[2-(trifluoromethyl)phenyl]urea

SMILES

O=C(NC1CCCCC1)Nc1c(C(F)(F)F)cccc1

InChI

InChI=1S/C14H17F3N2O/c15-14(16,17)11-8-4-5-9-12(11)19-13(20)18-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H2,18,19,20)

InChI Key

GKOUEWHYLFOVFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00590579

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

286.3

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.800

Distribution Coefficient, logD

3.800

Water Solubility, LogSw

-4.13

Polar Surface Area

32.891

Acid Dissociation Constant (pKa)

14.03

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

1682-3724 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with 1682-3724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-3724?
Check Price and Availability of 1682-3724, 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 1682-3724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-3724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-3724
  • 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 1682-3724 available by request