C710-0055 Screening compound: 2-(3,4-dimethylphenyl)-1-hydroxy-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one

C710-0055 Screening compound: 2-(3,4-dimethylphenyl)-1-hydroxy-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one
C710-0055 Screening compound: 2-(3,4-dimethylphenyl)-1-hydroxy-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C710-0055
2-(3,4-dimethylphenyl)-1-hydroxy-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one

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

C710-0055

Molecular Formula

C15H15N3O2 (C15 H15 N3 O2)

Compound Name

2-(3,4-dimethylphenyl)-1-hydroxy-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one

IUPAC name

2-(34-dimethylphenyl)-1-hydroxy-1234-tetrahydro-124-benzotriazin-3-one

SMILES

Cc(cc1)c(C)cc1N(C(Nc1c2cccc1)=O)N2O

InChI

InChI=1S/C15H15N3O2/c1-10-7-8-12(9-11(10)2)17-15(19)16-13-5-3-4-6-14(13)18(17)20/h3-9,20H,1-2H3,(H,16,19)

InChI Key

ABAJOMSIVKWJKM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14786917

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.3

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.401

Distribution Coefficient, logD

3.285

Water Solubility, LogSw

-3.72

Polar Surface Area

48.615

Acid Dissociation Constant (pKa)

7.92

Base Dissociation Constant (pKb)

-2.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

C710-0055 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C710-0055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C710-0055?
Check Price and Availability of C710-0055, 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 C710-0055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C710-0055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C710-0055
  • 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 C710-0055 available by request