Y505-3696 Screening compound: N'~1~-{[1-(2,2,2-TRIFLUOROETHYL)-1H-PYRAZOL-3-YL]METHYLENE}-1-CYCLOHEXANECARBOHYDRAZIDE

Y505-3696 Screening compound: N'~1~-{[1-(2,2,2-TRIFLUOROETHYL)-1H-PYRAZOL-3-YL]METHYLENE}-1-CYCLOHEXANECARBOHYDRAZIDE
Y505-3696 Screening compound: N'~1~-{[1-(2,2,2-TRIFLUOROETHYL)-1H-PYRAZOL-3-YL]METHYLENE}-1-CYCLOHEXANECARBOHYDRAZIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y505-3696
N'~1~-{[1-(2,2,2-TRIFLUOROETHYL)-1H-PYRAZOL-3-YL]METHYLENE}-1-CYCLOHEXANECARBOHYDRAZIDE

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

Y505-3696

Molecular Formula

C13H17F3N4O (C13 H17 F3 N4 O)

Compound Name

N'~1~-{[1-(2,2,2-TRIFLUOROETHYL)-1H-PYRAZOL-3-YL]METHYLENE}-1-CYCLOHEXANECARBOHYDRAZIDE

IUPAC name

n/a

SMILES

O=C(C1CCCCC1)N/N=C/c1nn(CC(F)(F)F)cc1

InChI

InChI=1S/C13H17F3N4O/c14-13(15,16)9-20-7-6-11(19-20)8-17-18-12(21)10-4-2-1-3-5-10/h6-8,10H,1-5,9H2,(H,18,21)

InChI Key

NVUDYFHCAUKYCR-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.715

Distribution Coefficient, logD

2.715

Water Solubility, LogSw

-2.96

Polar Surface Area

50.902

Acid Dissociation Constant (pKa)

10.63

Base Dissociation Constant (pKb)

1.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.50

References: we are preparing a list of scientific research reports with Y505-3696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y505-3696?
Check Price and Availability of Y505-3696, 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 Y505-3696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y505-3696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y505-3696
  • 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 Y505-3696 available by request