F120-0328 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-3-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea

F120-0328 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-3-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea
F120-0328 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-3-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound F120-0328
1-(2H-1,3-benzodioxol-5-yl)-3-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-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

F120-0328

Molecular Formula

C18H15F3N4O3 (C18 H15 F3 N4 O3)

Compound Name

1-(2H-1,3-benzodioxol-5-yl)-3-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}urea

IUPAC name

1-(2H-13-benzodioxol-5-yl)-3-{2-[2-(trifluoromethyl)-1H-13-benzodiazol-1-yl]ethyl}urea

SMILES

O=C(NCCn1c(cccc2)c2nc1C(F)(F)F)Nc(cc1)cc2c1OCO2

InChI

InChI=1S/C18H15F3N4O3/c19-18(20,21)16-24-12-3-1-2-4-13(12)25(16)8-7-22-17(26)23-11-5-6-14-15(9-11)28-10-27-14/h1-6,9H,7-8,10H2,(H2,22,23,26)

InChI Key

GFIHJHAVHBQHAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14942266

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.902

Distribution Coefficient, logD

3.902

Water Solubility, LogSw

-4.12

Polar Surface Area

60.999

Acid Dissociation Constant (pKa)

12.14

Base Dissociation Constant (pKb)

2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

F120-0328 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F120-0328 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F120-0328?
Check Price and Availability of F120-0328, 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 F120-0328 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F120-0328
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F120-0328
  • 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 F120-0328 available by request