5634-0034 Screening compound: 3-cyclohexyl-1-(phenylsulfonyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol

5634-0034 Screening compound: 3-cyclohexyl-1-(phenylsulfonyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
5634-0034 Screening compound: 3-cyclohexyl-1-(phenylsulfonyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 5634-0034
3-cyclohexyl-1-(phenylsulfonyl)-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

5634-0034

Molecular Formula

C16H19F3N2O3S (C16 H19 F3 N2 O3 S)

Compound Name

3-cyclohexyl-1-(phenylsulfonyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol

IUPAC name

n/a

SMILES

OC(CC(C1CCCCC1)=N1)(C(F)(F)F)N1S(c1ccccc1)(=O)=O

InChI

InChI=1S/C16H19F3N2O3S/c17-16(18,19)15(22)11-14(12-7-3-1-4-8-12)20-21(15)25(23,24)13-9-5-2-6-10-13/h2,5-6,9-10,12,22H,1,3-4,7-8,11H2/t15-/m0/s1

InChI Key

ZORCUXUIBSLCPX-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD03827710

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.950

Distribution Coefficient, logD

3.950

Water Solubility, LogSw

-3.88

Polar Surface Area

58.947

Acid Dissociation Constant (pKa)

11.86

Base Dissociation Constant (pKb)

0.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.30

5634-0034 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5634-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5634-0034?
Check Price and Availability of 5634-0034, 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 5634-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5634-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5634-0034
  • 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 5634-0034 available by request