C710-0076 Screening compound: 1-hydroxy-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one

C710-0076 Screening compound: 1-hydroxy-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one
C710-0076 Screening compound: 1-hydroxy-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C710-0076
1-hydroxy-2-(6-methyl-1,3-benzothiazol-2-yl)-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

C710-0076

Molecular Formula

C15H12N4O2S (C15 H12 N4 O2 S)

Compound Name

1-hydroxy-2-(6-methyl-1,3-benzothiazol-2-yl)-1,2,3,4-tetrahydro-1,2,4-benzotriazin-3-one

IUPAC name

1-hydroxy-2-(6-methyl-13-benzothiazol-2-yl)-1234-tetrahydro-124-benzotriazin-3-one

SMILES

Cc(cc1)cc2c1nc(N(C(Nc1c3cccc1)=O)N3O)s2

InChI

InChI=1S/C15H12N4O2S/c1-9-6-7-11-13(8-9)22-15(17-11)18-14(20)16-10-4-2-3-5-12(10)19(18)21/h2-8,21H,1H3,(H,16,20)

InChI Key

LIUNDNJPELNKOU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14786931

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.510

Distribution Coefficient, logD

2.844

Water Solubility, LogSw

-3.82

Polar Surface Area

58.150

Acid Dissociation Constant (pKa)

6.84

Base Dissociation Constant (pKb)

0.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

C710-0076 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C710-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C710-0076?
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What is the minimum amount of C710-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C710-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C710-0076
  • 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 C710-0076 available by request