0338-0079 Screening compound: N-({N'-[(2Z)-butan-2-ylidene]hydrazinecarbonyl}methyl)-2,4-dichlorobenzamide

0338-0079 Screening compound: N-({N'-[(2Z)-butan-2-ylidene]hydrazinecarbonyl}methyl)-2,4-dichlorobenzamide
0338-0079 Screening compound: N-({N'-[(2Z)-butan-2-ylidene]hydrazinecarbonyl}methyl)-2,4-dichlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0338-0079
N-({N'-[(2Z)-butan-2-ylidene]hydrazinecarbonyl}methyl)-2,4-dichlorobenzamide

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

0338-0079

Molecular Formula

C13H15Cl2N3O2 (C13 H15 Cl2 N3 O2)

Compound Name

N-({N'-[(2Z)-butan-2-ylidene]hydrazinecarbonyl}methyl)-2,4-dichlorobenzamide

IUPAC name

N-({N'-[(2Z)-butan-2-ylidene]hydrazinecarbonyl}methyl)-24-dichlorobenzamide

SMILES

CC/C(/C)=N\NC(CNC(c(ccc(Cl)c1)c1Cl)=O)=O

InChI

InChI=1S/C13H15Cl2N3O2/c1-3-8(2)17-18-12(19)7-16-13(20)10-5-4-9(14)6-11(10)15/h4-6H,3,7H2,1-2H3,(H,16,20)(H,18,19)

InChI Key

WSQZTYYGEKZULK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00422024

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.19

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.314

Distribution Coefficient, logD

3.314

Water Solubility, LogSw

-3.71

Polar Surface Area

59.666

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

0338-0079 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0338-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0338-0079?
Check Price and Availability of 0338-0079, 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 0338-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0338-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0338-0079
  • 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 0338-0079 available by request