F445-0408 Screening compound: 3-(4-CHLOROPHENYL)-N4-(2

F445-0408 Screening compound: 3-(4-CHLOROPHENYL)-N4-(2
F445-0408 Screening compound: 3-(4-CHLOROPHENYL)-N4-(2 alternative view

Chemical Structure Depiction of ChemDiv screening compound F445-0408
3-(4-CHLOROPHENYL)-N4-(2

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

F445-0408

Molecular Formula

C22H22ClN3O3 (C22 H22 ClN3 O3)

Compound Name

3-(4-CHLOROPHENYL)-N4-(2

IUPAC name

n/a

SMILES

Cc(cc1)cc(C)c1NC(c1c(N2CCOCC2)onc1-c(cc1)ccc1Cl)=O

InChI

InChI=1S/C22H22ClN3O3/c1-14-3-8-18(15(2)13-14)24-21(27)19-20(16-4-6-17(23)7-5-16)25-29-22(19)26-9-11-28-12-10-26/h3-8,13H,9-12H2,1-2H3,(H,24,27)

InChI Key

FAOSFOGEMBUCQQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14954436

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.89

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.577

Distribution Coefficient, logD

4.577

Water Solubility, LogSw

-4.91

Polar Surface Area

56.838

Acid Dissociation Constant (pKa)

11.89

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

F445-0408 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F445-0408 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F445-0408?
Check Price and Availability of F445-0408, 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 F445-0408 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F445-0408
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F445-0408
  • 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 F445-0408 available by request