5025-0043 Screening compound: 1-(10H-phenothiazin-10-yl)-2-[(1-phenyl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]-1-ethanone

5025-0043 Screening compound: 1-(10H-phenothiazin-10-yl)-2-[(1-phenyl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]-1-ethanone
5025-0043 Screening compound: 1-(10H-phenothiazin-10-yl)-2-[(1-phenyl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound 5025-0043
1-(10H-phenothiazin-10-yl)-2-[(1-phenyl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]-1-ethanone

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

5025-0043

Molecular Formula

C21H15N5OS2 (C21 H15 N5 OS2)

Compound Name

1-(10H-phenothiazin-10-yl)-2-[(1-phenyl-1H-1,2,3,4-tetraazol-5-yl)sulfanyl]-1-ethanone

IUPAC name

1-(10H-phenothiazin-10-yl)-2-[(1-phenyl-1H-1234-tetrazol-5-yl)sulfanyl]ethan-1-one

SMILES

O=C(CSc1nnnn1-c1ccccc1)N1c(cccc2)c2Sc2c1cccc2

InChI

InChI=1S/C21H15N5OS2/c27-20(14-28-21-22-23-24-26(21)15-8-2-1-3-9-15)25-16-10-4-6-12-18(16)29-19-13-7-5-11-17(19)25/h1-13H,14H2

InChI Key

TXHKFXJFGPPZNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02212631

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.341

Distribution Coefficient, logD

4.341

Water Solubility, LogSw

-4.38

Polar Surface Area

53.264

Acid Dissociation Constant (pKa)

17.08

Base Dissociation Constant (pKb)

-2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.76

5025-0043 in Drug Discovery

Included in Screening Libraries

Nucleic Acid Ligands (8311 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system

References: we are preparing a list of scientific research reports with 5025-0043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5025-0043?
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What is the minimum amount of 5025-0043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5025-0043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5025-0043
  • 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 5025-0043 available by request