F779-0777 Screening compound: N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-3,4,5-trimethoxybenzamide

F779-0777 Screening compound: N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-3,4,5-trimethoxybenzamide
F779-0777 Screening compound: N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-3,4,5-trimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F779-0777
N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-3,4,5-trimethoxybenzamide

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

F779-0777

Molecular Formula

C25H25N3O4 (C25 H25 N3 O4)

Compound Name

N-{3-[2-(1H-1,3-benzodiazol-2-yl)ethyl]phenyl}-3,4,5-trimethoxybenzamide

IUPAC name

N-{3-[2-(1H-13-benzodiazol-2-yl)ethyl]phenyl}-345-trimethoxybenzamide

SMILES

COc1cc(C(Nc2cc(CCc3nc(cccc4)c4[nH]3)ccc2)=O)cc(OC)c1OC

InChI

InChI=1S/C25H25N3O4/c1-30-21-14-17(15-22(31-2)24(21)32-3)25(29)26-18-8-6-7-16(13-18)11-12-23-27-19-9-4-5-10-20(19)28-23/h4-10,13-15H,11-12H2,1-3H3,(H,26,29)(H,27,28)

InChI Key

PIRUGUSPAXZRLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14966155

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.478

Distribution Coefficient, logD

4.453

Water Solubility, LogSw

-4.47

Polar Surface Area

66.318

Acid Dissociation Constant (pKa)

11.93

Base Dissociation Constant (pKb)

6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

F779-0777 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system

References: we are preparing a list of scientific research reports with F779-0777 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F779-0777?
Check Price and Availability of F779-0777, 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 F779-0777 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F779-0777
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F779-0777
  • 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 F779-0777 available by request