F484-0582 Screening compound: 3-methyl-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzamide

F484-0582 Screening compound: 3-methyl-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzamide
F484-0582 Screening compound: 3-methyl-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F484-0582
3-methyl-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzamide

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

F484-0582

Molecular Formula

C18H16F3N3O (C18 H16 F3 N3 O)

Compound Name

3-methyl-N-{2-[2-(trifluoromethyl)-1H-1,3-benzodiazol-1-yl]ethyl}benzamide

IUPAC name

3-methyl-N-{2-[2-(trifluoromethyl)-1H-13-benzodiazol-1-yl]ethyl}benzamide

SMILES

Cc1cccc(C(NCCn2c(cccc3)c3nc2C(F)(F)F)=O)c1

InChI

InChI=1S/C18H16F3N3O/c1-12-5-4-6-13(11-12)16(25)22-9-10-24-15-8-3-2-7-14(15)23-17(24)18(19,20)21/h2-8,11H,9-10H2,1H3,(H,22,25)

InChI Key

VYBSYCMJJHTNFY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27133551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.997

Distribution Coefficient, logD

3.997

Water Solubility, LogSw

-4.09

Polar Surface Area

34.672

Acid Dissociation Constant (pKa)

12.53

Base Dissociation Constant (pKb)

0.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

F484-0582 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 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 F484-0582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F484-0582?
Check Price and Availability of F484-0582, 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 F484-0582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F484-0582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F484-0582
  • 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 F484-0582 available by request