3664-0066 Screening compound: N'-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-4-methoxybenzohydrazide

3664-0066 Screening compound: N'-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-4-methoxybenzohydrazide
3664-0066 Screening compound: N'-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-4-methoxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3664-0066
N'-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-4-methoxybenzohydrazide

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

3664-0066

Molecular Formula

C17H20N2O4 (C17 H20 N2 O4)

Compound Name

N'-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-4-methoxybenzohydrazide

IUPAC name

N'-[(44-dimethyl-26-dioxocyclohexylidene)methyl]-4-methoxybenzohydrazide

SMILES

CC(C)(CC(C1=CNNC(c(cc2)ccc2OC)=O)=O)CC1=O

InChI

InChI=1S/C17H20N2O4/c1-17(2)8-14(20)13(15(21)9-17)10-18-19-16(22)11-4-6-12(23-3)7-5-11/h4-7,10,18H,8-9H2,1-3H3,(H,19,22)

InChI Key

COGHEKFOGWIVJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00520830

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.387

Distribution Coefficient, logD

1.048

Water Solubility, LogSw

-1.82

Polar Surface Area

74.244

Acid Dissociation Constant (pKa)

7.33

Base Dissociation Constant (pKb)

-0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

References: we are preparing a list of scientific research reports with 3664-0066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3664-0066?
Check Price and Availability of 3664-0066, 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 3664-0066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3664-0066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3664-0066
  • 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 3664-0066 available by request