F090-1849 Screening compound: 2-[2-amino-5-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(benzyloxy)phenol

F090-1849 Screening compound: 2-[2-amino-5-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(benzyloxy)phenol
F090-1849 Screening compound: 2-[2-amino-5-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(benzyloxy)phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound F090-1849
2-[2-amino-5-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(benzyloxy)phenol

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

F090-1849

Molecular Formula

C25H20F3N3O3 (C25 H20 F3 N3 O3)

Compound Name

2-[2-amino-5-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(benzyloxy)phenol

IUPAC name

2-[2-amino-5-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-(benzyloxy)phenol

SMILES

COc(cc1)ccc1-c1c(-c(ccc(OCc2ccccc2)c2)c2O)nc(N)nc1C(F)(F)F

InChI

InChI=1S/C25H20F3N3O3/c1-33-17-9-7-16(8-10-17)21-22(30-24(29)31-23(21)25(26,27)28)19-12-11-18(13-20(19)32)34-14-15-5-3-2-4-6-15/h2-13,32H,14H2,1H3,(H2,29,30,31)

InChI Key

VZHJMPCUNHWANS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07639741

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.063

Distribution Coefficient, logD

6.062

Water Solubility, LogSw

-5.61

Polar Surface Area

71.593

Acid Dissociation Constant (pKa)

10.08

Base Dissociation Constant (pKb)

2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

F090-1849 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with F090-1849 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F090-1849?
Check Price and Availability of F090-1849, 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 F090-1849 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F090-1849
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F090-1849
  • 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 F090-1849 available by request