C174-0742 Screening compound: N-[3-(1-ethyl-1H-1,3-benzodiazol-2-yl)propyl]-4-fluorobenzamide

C174-0742 Screening compound: N-[3-(1-ethyl-1H-1,3-benzodiazol-2-yl)propyl]-4-fluorobenzamide
C174-0742 Screening compound: N-[3-(1-ethyl-1H-1,3-benzodiazol-2-yl)propyl]-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C174-0742
N-[3-(1-ethyl-1H-1,3-benzodiazol-2-yl)propyl]-4-fluorobenzamide

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

C174-0742

Molecular Formula

C19H20FN3O (C19 H20 FN3 O)

Compound Name

N-[3-(1-ethyl-1H-1,3-benzodiazol-2-yl)propyl]-4-fluorobenzamide

IUPAC name

N-[3-(1-ethyl-1H-13-benzodiazol-2-yl)propyl]-4-fluorobenzamide

SMILES

CCn1c(cccc2)c2nc1CCCNC(c(cc1)ccc1F)=O

InChI

InChI=1S/C19H20FN3O/c1-2-23-17-7-4-3-6-16(17)22-18(23)8-5-13-21-19(24)14-9-11-15(20)12-10-14/h3-4,6-7,9-12H,2,5,8,13H2,1H3,(H,21,24)

InChI Key

WAWYNVLJHVVPKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04459243

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.377

Distribution Coefficient, logD

3.372

Water Solubility, LogSw

-3.61

Polar Surface Area

35.394

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

5.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

C174-0742 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Dark Chemical Matter Library (18430 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
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C174-0742 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C174-0742?
Check Price and Availability of C174-0742, 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 C174-0742 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C174-0742
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C174-0742
  • 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 C174-0742 available by request