Y505-3868 Screening compound: N'~1~-[(5-FLUORO-1,3-DIMETHYL-1H-PYRAZOL-4-YL)METHYLENE]-3-(3-NITRO-1H-PYRAZOL-1-YL)PROPANOHYDRAZIDE

Y505-3868 Screening compound: N'~1~-[(5-FLUORO-1,3-DIMETHYL-1H-PYRAZOL-4-YL)METHYLENE]-3-(3-NITRO-1H-PYRAZOL-1-YL)PROPANOHYDRAZIDE
Y505-3868 Screening compound: N'~1~-[(5-FLUORO-1,3-DIMETHYL-1H-PYRAZOL-4-YL)METHYLENE]-3-(3-NITRO-1H-PYRAZOL-1-YL)PROPANOHYDRAZIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y505-3868
N'~1~-[(5-FLUORO-1,3-DIMETHYL-1H-PYRAZOL-4-YL)METHYLENE]-3-(3-NITRO-1H-PYRAZOL-1-YL)PROPANOHYDRAZIDE

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

Y505-3868

Molecular Formula

C12H14FN7O3 (C12 H14 FN7 O3)

Compound Name

N'~1~-[(5-FLUORO-1,3-DIMETHYL-1H-PYRAZOL-4-YL)METHYLENE]-3-(3-NITRO-1H-PYRAZOL-1-YL)PROPANOHYDRAZIDE

IUPAC name

n/a

SMILES

Cc1nn(C)c(F)c1/C=N/NC(CCn(cc1)nc1[N+]([O-])=O)=O

InChI

InChI=1S/C12H14FN7O3/c1-8-9(12(13)18(2)16-8)7-14-15-11(21)4-6-19-5-3-10(17-19)20(22)23/h3,5,7H,4,6H2,1-2H3,(H,15,21)

InChI Key

OAJLDKVLOXHVSW-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.29

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.052

Distribution Coefficient, logD

0.045

Water Solubility, LogSw

-1.86

Polar Surface Area

98.469

Acid Dissociation Constant (pKa)

9.18

Base Dissociation Constant (pKb)

5.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with Y505-3868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y505-3868?
Check Price and Availability of Y505-3868, 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 Y505-3868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y505-3868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y505-3868
  • 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 Y505-3868 available by request