D215-0161 Screening compound: [(2-methylphenyl)methyl]({2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl})amine

D215-0161 Screening compound: [(2-methylphenyl)methyl]({2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl})amine
D215-0161 Screening compound: [(2-methylphenyl)methyl]({2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl})amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D215-0161
[(2-methylphenyl)methyl]({2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl})amine

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

D215-0161

Molecular Formula

C17H19N5S (C17 H19 N5 S)

Compound Name

[(2-methylphenyl)methyl]({2-[(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl})amine

IUPAC name

[(2-methylphenyl)methyl]({2-[(1-phenyl-1H-1234-tetrazol-5-yl)sulfanyl]ethyl})amine

SMILES

Cc1c(CNCCSc2nnnn2-c2ccccc2)cccc1

InChI

InChI=1S/C17H19N5S/c1-14-7-5-6-8-15(14)13-18-11-12-23-17-19-20-21-22(17)16-9-3-2-4-10-16/h2-10,18H,11-13H2,1H3

InChI Key

HTBVYULQHJKPOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07434460

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

325.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.336

Distribution Coefficient, logD

1.001

Water Solubility, LogSw

-3.36

Polar Surface Area

51.768

Acid Dissociation Constant (pKa)

25.64

Base Dissociation Constant (pKb)

9.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

D215-0161 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with D215-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D215-0161?
Check Price and Availability of D215-0161, 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 D215-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D215-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D215-0161
  • 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 D215-0161 available by request