C710-0071 Screening compound: ethyl 2-(1-hydroxy-3-oxo-1,2,3,4-tetrahydro-1,2,4-benzotriazin-2-yl)benzoate

C710-0071 Screening compound: ethyl 2-(1-hydroxy-3-oxo-1,2,3,4-tetrahydro-1,2,4-benzotriazin-2-yl)benzoate
C710-0071 Screening compound: ethyl 2-(1-hydroxy-3-oxo-1,2,3,4-tetrahydro-1,2,4-benzotriazin-2-yl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C710-0071
ethyl 2-(1-hydroxy-3-oxo-1,2,3,4-tetrahydro-1,2,4-benzotriazin-2-yl)benzoate

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

C710-0071

Molecular Formula

C16H15N3O4 (C16 H15 N3 O4)

Compound Name

ethyl 2-(1-hydroxy-3-oxo-1,2,3,4-tetrahydro-1,2,4-benzotriazin-2-yl)benzoate

IUPAC name

ethyl 2-(1-hydroxy-3-oxo-1234-tetrahydro-124-benzotriazin-2-yl)benzoate

SMILES

CCOC(c(cccc1)c1N(C(Nc1c2cccc1)=O)N2O)=O

InChI

InChI=1S/C16H15N3O4/c1-2-23-15(20)11-7-3-5-9-13(11)18-16(21)17-12-8-4-6-10-14(12)19(18)22/h3-10,22H,2H2,1H3,(H,17,21)

InChI Key

BESSKGTXRVBIDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14786928

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.699

Distribution Coefficient, logD

2.583

Water Solubility, LogSw

-3.33

Polar Surface Area

69.068

Acid Dissociation Constant (pKa)

7.92

Base Dissociation Constant (pKb)

-5.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with C710-0071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C710-0071?
Check Price and Availability of C710-0071, 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 C710-0071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C710-0071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C710-0071
  • 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 C710-0071 available by request