C710-0083 Screening compound: 2-(3-chloro-4-methoxyphenyl)-1-hydroxy-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one

C710-0083 Screening compound: 2-(3-chloro-4-methoxyphenyl)-1-hydroxy-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one
C710-0083 Screening compound: 2-(3-chloro-4-methoxyphenyl)-1-hydroxy-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C710-0083
2-(3-chloro-4-methoxyphenyl)-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

C710-0083

Molecular Formula

C14H12ClN3O3 (C14 H12 ClN3 O3)

Compound Name

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

IUPAC name

2-(3-chloro-4-methoxyphenyl)-1-hydroxy-1234-tetrahydro-124-benzotriazin-3-one

SMILES

COc(ccc(N(C(Nc1c2cccc1)=O)N2O)c1)c1Cl

InChI

InChI=1S/C14H12ClN3O3/c1-21-13-7-6-9(8-10(13)15)17-14(19)16-11-4-2-3-5-12(11)18(17)20/h2-8,20H,1H3,(H,16,19)

InChI Key

UNMFJWLQXQKVBP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14786936

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.72

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.643

Distribution Coefficient, logD

2.528

Water Solubility, LogSw

-3.48

Polar Surface Area

56.245

Acid Dissociation Constant (pKa)

7.92

Base Dissociation Constant (pKb)

-3.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

References: we are preparing a list of scientific research reports with C710-0083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C710-0083?
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What is the minimum amount of C710-0083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C710-0083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C710-0083
  • 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 C710-0083 available by request