6495-1296 Screening compound: 1-phenyl-5-(propan-2-ylsulfanyl)-1H-1,2,3,4-tetrazole

6495-1296 Screening compound: 1-phenyl-5-(propan-2-ylsulfanyl)-1H-1,2,3,4-tetrazole
6495-1296 Screening compound: 1-phenyl-5-(propan-2-ylsulfanyl)-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6495-1296
1-phenyl-5-(propan-2-ylsulfanyl)-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

6495-1296

Molecular Formula

C10H12N4S (C10 H12 N4 S)

Compound Name

1-phenyl-5-(propan-2-ylsulfanyl)-1H-1,2,3,4-tetrazole

IUPAC name

1-phenyl-5-(propan-2-ylsulfanyl)-1H-1234-tetrazole

SMILES

CC(C)Sc1nnnn1-c1ccccc1

InChI

InChI=1S/C10H12N4S/c1-8(2)15-10-11-12-13-14(10)9-6-4-3-5-7-9/h3-8H,1-2H3

InChI Key

SRXNAOIEUJQDHS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00447961

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

220.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.696

Distribution Coefficient, logD

2.696

Water Solubility, LogSw

-2.73

Polar Surface Area

40.160

Acid Dissociation Constant (pKa)

23.57

Base Dissociation Constant (pKb)

-1.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

6495-1296 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Human GPCR Annotated Library (5539 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 6495-1296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6495-1296?
Check Price and Availability of 6495-1296, 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 6495-1296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6495-1296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6495-1296
  • 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 6495-1296 available by request