F725-0331 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide

F725-0331 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide
F725-0331 Screening compound: N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F725-0331
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}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

F725-0331

Molecular Formula

C25H25FN4O (C25 H25 FN4 O)

Compound Name

N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-3-{[6-(4-fluorophenyl)pyrimidin-4-yl]amino}benzamide

SMILES

O=C(c1cccc(Nc2cc(-c(cc3)ccc3F)ncn2)c1)NCCC1=CCCCC1

InChI

InChI=1S/C25H25FN4O/c26-21-11-9-19(10-12-21)23-16-24(29-17-28-23)30-22-8-4-7-20(15-22)25(31)27-14-13-18-5-2-1-3-6-18/h4-5,7-12,15-17H,1-3,6,13-14H2,(H,27,31)(H,28,29,30)

InChI Key

RDOAFGCKLQXWPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14964800

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.565

Distribution Coefficient, logD

5.534

Water Solubility, LogSw

-5.91

Polar Surface Area

53.703

Acid Dissociation Constant (pKa)

13.91

Base Dissociation Constant (pKb)

6.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

F725-0331 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F725-0331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F725-0331?
Check Price and Availability of F725-0331, 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 F725-0331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F725-0331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F725-0331
  • 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 F725-0331 available by request