Y207-2564 Screening compound: 2-{4-allyl-5-[(3-chlorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}-4-chlorophenyl methyl ether

Y207-2564 Screening compound: 2-{4-allyl-5-[(3-chlorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}-4-chlorophenyl methyl ether
Y207-2564 Screening compound: 2-{4-allyl-5-[(3-chlorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}-4-chlorophenyl methyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound Y207-2564
2-{4-allyl-5-[(3-chlorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}-4-chlorophenyl methyl ether

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

Y207-2564

Molecular Formula

C19H17Cl2N3OS (C19 H17 Cl2 N3 OS)

Compound Name

2-{4-allyl-5-[(3-chlorobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}-4-chlorophenyl methyl ether

IUPAC name

3-(5-chloro-2-methoxyphenyl)-5-{[(3-chlorophenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-124-triazole

SMILES

COc(ccc(Cl)c1)c1-c(n1CC=C)nnc1SCc1cc(Cl)ccc1

InChI

InChI=1S/C19H17Cl2N3OS/c1-3-9-24-18(16-11-15(21)7-8-17(16)25-2)22-23-19(24)26-12-13-5-4-6-14(20)10-13/h3-8,10-11H,1,9,12H2,2H3

InChI Key

VQFKGEBRMXCBAZ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.573

Distribution Coefficient, logD

5.573

Water Solubility, LogSw

-5.97

Polar Surface Area

31.850

Acid Dissociation Constant (pKa)

21.44

Base Dissociation Constant (pKb)

2.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.79

References: we are preparing a list of scientific research reports with Y207-2564 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y207-2564?
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What is the minimum amount of Y207-2564 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y207-2564
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y207-2564
  • 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 Y207-2564 available by request