8010-4083 Screening compound: 5-{[2-nitro-4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole

8010-4083 Screening compound: 5-{[2-nitro-4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole
8010-4083 Screening compound: 5-{[2-nitro-4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-4083
5-{[2-nitro-4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole

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

8010-4083

Molecular Formula

C14H9N9O2S (C14 H9 N9 O2 S)

Compound Name

5-{[2-nitro-4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]sulfanyl}-1-phenyl-1H-1,2,3,4-tetrazole

IUPAC name

5-{[2-nitro-4-(1H-1234-tetrazol-1-yl)phenyl]sulfanyl}-1-phenyl-1H-1234-tetrazole

SMILES

[O-][N+](c(cc(cc1)-n2nnnc2)c1Sc1nnnn1-c1ccccc1)=O

InChI

InChI=1S/C14H9N9O2S/c24-23(25)12-8-11(21-9-15-17-19-21)6-7-13(12)26-14-16-18-20-22(14)10-4-2-1-3-5-10/h1-9H

InChI Key

NEYZPUSOACPWMQ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.35

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

2.926

Distribution Coefficient, logD

2.926

Water Solubility, LogSw

-3.54

Polar Surface Area

112.735

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8010-4083 in Drug Discovery

Included in Screening Libraries

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8010-4083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-4083?
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What is the minimum amount of 8010-4083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-4083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-4083
  • 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 8010-4083 available by request