1503-0372 Screening compound: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitrobenzamide

1503-0372 Screening compound: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitrobenzamide
1503-0372 Screening compound: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1503-0372
N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-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

1503-0372

Molecular Formula

C20H12N4O5S (C20 H12 N4 O5 S)

Compound Name

N-[2-(1,3-benzothiazol-2-yl)phenyl]-2,4-dinitrobenzamide

IUPAC name

N-[2-(13-benzothiazol-2-yl)phenyl]-24-dinitrobenzamide

SMILES

[O-][N+](c(cc1)cc([N+]([O-])=O)c1C(Nc(cccc1)c1-c1nc(cccc2)c2s1)=O)=O

InChI

InChI=1S/C20H12N4O5S/c25-19(14-10-9-12(23(26)27)11-17(14)24(28)29)21-15-6-2-1-5-13(15)20-22-16-7-3-4-8-18(16)30-20/h1-11H,(H,21,25)

InChI Key

QQKKDDUGKXTWFJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00858615

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.41

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.827

Distribution Coefficient, logD

4.802

Water Solubility, LogSw

-4.89

Polar Surface Area

98.543

Acid Dissociation Constant (pKa)

8.63

Base Dissociation Constant (pKb)

0.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 1503-0372 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1503-0372?
Check Price and Availability of 1503-0372, 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 1503-0372 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1503-0372
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1503-0372
  • 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 1503-0372 available by request