8019-6377 Screening compound: 2-(3,5-dinitrophenyl)-5-methoxy-2H-1,2,3-benzotriazole

8019-6377 Screening compound: 2-(3,5-dinitrophenyl)-5-methoxy-2H-1,2,3-benzotriazole
8019-6377 Screening compound: 2-(3,5-dinitrophenyl)-5-methoxy-2H-1,2,3-benzotriazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-6377
2-(3,5-dinitrophenyl)-5-methoxy-2H-1,2,3-benzotriazole

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

8019-6377

Molecular Formula

C13H9N5O5 (C13 H9 N5 O5)

Compound Name

2-(3,5-dinitrophenyl)-5-methoxy-2H-1,2,3-benzotriazole

IUPAC name

2-(35-dinitrophenyl)-5-methoxy-2H-123-benzotriazole

SMILES

COc1cc2nn(-c3cc([N+]([O-])=O)cc([N+]([O-])=O)c3)nc2cc1

InChI

InChI=1S/C13H9N5O5/c1-23-11-2-3-12-13(7-11)15-16(14-12)8-4-9(17(19)20)6-10(5-8)18(21)22/h2-7H,1H3

InChI Key

XVELQIZIBJQVFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10038710

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.25

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.959

Distribution Coefficient, logD

2.959

Water Solubility, LogSw

-3.33

Polar Surface Area

98.579

Acid Dissociation Constant (pKa)

31.55

Base Dissociation Constant (pKb)

0.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

References: we are preparing a list of scientific research reports with 8019-6377 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-6377?
Check Price and Availability of 8019-6377, 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 8019-6377 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-6377
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-6377
  • 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 8019-6377 available by request