Y207-4216 Screening compound: 3-benzyl-5-[(2-chloro-4-fluorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazole

Y207-4216 Screening compound: 3-benzyl-5-[(2-chloro-4-fluorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazole
Y207-4216 Screening compound: 3-benzyl-5-[(2-chloro-4-fluorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazole alternative view

Chemical Structure Depiction of ChemDiv screening compound Y207-4216
3-benzyl-5-[(2-chloro-4-fluorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazole

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

Y207-4216

Molecular Formula

C18H17ClFN3S (C18 H17 ClFN3 S)

Compound Name

3-benzyl-5-[(2-chloro-4-fluorobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazole

IUPAC name

3-benzyl-5-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-4-ethyl-4H-124-triazole

SMILES

CCn1c(SCc(ccc(F)c2)c2Cl)nnc1Cc1ccccc1

InChI

InChI=1S/C18H17ClFN3S/c1-2-23-17(10-13-6-4-3-5-7-13)21-22-18(23)24-12-14-8-9-15(20)11-16(14)19/h3-9,11H,2,10,12H2,1H3

InChI Key

IMJOSXGSABFDHR-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.87

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.964

Distribution Coefficient, logD

4.964

Water Solubility, LogSw

-5.23

Polar Surface Area

24.942

Acid Dissociation Constant (pKa)

20.54

Base Dissociation Constant (pKb)

2.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

References: we are preparing a list of scientific research reports with Y207-4216 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y207-4216?
Check Price and Availability of Y207-4216, 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 Y207-4216 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y207-4216
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y207-4216
  • 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 Y207-4216 available by request