D015-0275 Screening compound: 1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one

D015-0275 Screening compound: 1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one
D015-0275 Screening compound: 1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D015-0275
1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one

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

D015-0275

Molecular Formula

C15H17F3N2O3 (C15 H17 F3 N2 O3)

Compound Name

1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one

IUPAC name

1-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-45-dihydro-1H-pyrazol-1-yl]-3-(2-hydroxyphenyl)propan-1-one

SMILES

CCC(CC1(C(F)(F)F)O)=NN1C(CCc(cccc1)c1O)=O

InChI

InChI=1S/C15H17F3N2O3/c1-2-11-9-14(23,15(16,17)18)20(19-11)13(22)8-7-10-5-3-4-6-12(10)21/h3-6,21,23H,2,7-9H2,1H3/t14-/m0/s1

InChI Key

JJARCHFROJHLTJ-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD05238422

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.31

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.471

Distribution Coefficient, logD

2.471

Water Solubility, LogSw

-2.18

Polar Surface Area

59.714

Acid Dissociation Constant (pKa)

10.70

Base Dissociation Constant (pKb)

2.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.70

D015-0275 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with D015-0275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D015-0275?
Check Price and Availability of D015-0275, 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 D015-0275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D015-0275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D015-0275
  • 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 D015-0275 available by request