8005-2508 Screening compound: N'~1~-(2,2-dicyano-1-methylvinyl)-4-methylbenzohydrazide

8005-2508 Screening compound: N'~1~-(2,2-dicyano-1-methylvinyl)-4-methylbenzohydrazide
8005-2508 Screening compound: N'~1~-(2,2-dicyano-1-methylvinyl)-4-methylbenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-2508
N'~1~-(2,2-dicyano-1-methylvinyl)-4-methylbenzohydrazide

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

8005-2508

Molecular Formula

C13H12N4O (C13 H12 N4 O)

Compound Name

N'~1~-(2,2-dicyano-1-methylvinyl)-4-methylbenzohydrazide

IUPAC name

N'-(11-dicyanoprop-1-en-2-yl)-4-methylbenzohydrazide

SMILES

CC(NNC(c1ccc(C)cc1)=O)=C(C#N)C#N

InChI

InChI=1S/C13H12N4O/c1-9-3-5-11(6-4-9)13(18)17-16-10(2)12(7-14)8-15/h3-6,16H,1-2H3,(H,17,18)

InChI Key

MBIRKWAYPHFOIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00738933

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.571

Distribution Coefficient, logD

0.437

Water Solubility, LogSw

-2.00

Polar Surface Area

72.677

Acid Dissociation Constant (pKa)

6.30

Base Dissociation Constant (pKb)

2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.38

References: we are preparing a list of scientific research reports with 8005-2508 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-2508?
Check Price and Availability of 8005-2508, 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 8005-2508 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-2508
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-2508
  • 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 8005-2508 available by request