D140-0080 Screening compound: 3-(2-hydroxyphenyl)-1-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol

D140-0080 Screening compound: 3-(2-hydroxyphenyl)-1-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
D140-0080 Screening compound: 3-(2-hydroxyphenyl)-1-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D140-0080
3-(2-hydroxyphenyl)-1-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol

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

D140-0080

Molecular Formula

C16H13F3N2O2 (C16 H13 F3 N2 O2)

Compound Name

3-(2-hydroxyphenyl)-1-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol

IUPAC name

3-(2-hydroxyphenyl)-1-phenyl-5-(trifluoromethyl)-45-dihydro-1H-pyrazol-5-ol

SMILES

OC(C1)(C(F)(F)F)N(c2ccccc2)N=C1c(cccc1)c1O

InChI

InChI=1S/C16H13F3N2O2/c17-16(18,19)15(23)10-13(12-8-4-5-9-14(12)22)20-21(15)11-6-2-1-3-7-11/h1-9,22-23H,10H2/t15-/m0/s1

InChI Key

UYKFPRIDDUAPJS-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD14812360

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.29

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.987

Distribution Coefficient, logD

3.982

Water Solubility, LogSw

-3.50

Polar Surface Area

46.870

Acid Dissociation Constant (pKa)

9.38

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.80

References: we are preparing a list of scientific research reports with D140-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D140-0080?
Check Price and Availability of D140-0080, 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 D140-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D140-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D140-0080
  • 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 D140-0080 available by request