1896-0162 Screening compound: (1E)-1,3-bis(3-nitrophenyl)-3-propyltriaz-1-ene

1896-0162 Screening compound: (1E)-1,3-bis(3-nitrophenyl)-3-propyltriaz-1-ene
1896-0162 Screening compound: (1E)-1,3-bis(3-nitrophenyl)-3-propyltriaz-1-ene alternative view

Chemical Structure Depiction of ChemDiv screening compound 1896-0162
(1E)-1,3-bis(3-nitrophenyl)-3-propyltriaz-1-ene

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

1896-0162

Molecular Formula

C15H15N5O4 (C15 H15 N5 O4)

Compound Name

(1E)-1,3-bis(3-nitrophenyl)-3-propyltriaz-1-ene

IUPAC name

(1E)-13-bis(3-nitrophenyl)-3-propyltriaz-1-ene

SMILES

CCCN(c1cc([N+]([O-])=O)ccc1)/N=N/c1cccc([N+]([O-])=O)c1

InChI

InChI=1S/C15H15N5O4/c1-2-9-18(13-6-4-8-15(11-13)20(23)24)17-16-12-5-3-7-14(10-12)19(21)22/h3-8,10-11H,2,9H2,1H3

InChI Key

BIEKBOAPWJBVSP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01347422

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.32

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.545

Distribution Coefficient, logD

4.545

Water Solubility, LogSw

-4.32

Polar Surface Area

90.112

Acid Dissociation Constant (pKa)

25.79

Base Dissociation Constant (pKb)

-0.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

1896-0162 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

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 1896-0162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1896-0162?
Check Price and Availability of 1896-0162, 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 1896-0162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1896-0162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1896-0162
  • 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 1896-0162 available by request