3384-8030 Screening compound: N-(4-methyl-1,3-thiazol-2-yl)-3,5-dinitrobenzamide

3384-8030 Screening compound: N-(4-methyl-1,3-thiazol-2-yl)-3,5-dinitrobenzamide
3384-8030 Screening compound: N-(4-methyl-1,3-thiazol-2-yl)-3,5-dinitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3384-8030
N-(4-methyl-1,3-thiazol-2-yl)-3,5-dinitrobenzamide

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

3384-8030

Molecular Formula

C11H8N4O5S (C11 H8 N4 O5 S)

Compound Name

N-(4-methyl-1,3-thiazol-2-yl)-3,5-dinitrobenzamide

IUPAC name

N-(4-methyl-13-thiazol-2-yl)-35-dinitrobenzamide

SMILES

Cc1csc(NC(c2cc([N+]([O-])=O)cc([N+]([O-])=O)c2)=O)n1

InChI

InChI=1S/C11H8N4O5S/c1-6-5-21-11(12-6)13-10(16)7-2-8(14(17)18)4-9(3-7)15(19)20/h2-5H,1H3,(H,12,13,16)

InChI Key

CBHAZZSTPYAOQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00843346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.27

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.644

Distribution Coefficient, logD

0.623

Water Solubility, LogSw

-3.00

Polar Surface Area

99.945

Acid Dissociation Constant (pKa)

5.38

Base Dissociation Constant (pKb)

1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

3384-8030 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 3384-8030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3384-8030?
Check Price and Availability of 3384-8030, 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 3384-8030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3384-8030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3384-8030
  • 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 3384-8030 available by request