Y206-6310 Screening compound: 4-{4-allyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}phenyl cyclopentyl ether

Y206-6310 Screening compound: 4-{4-allyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}phenyl cyclopentyl ether
Y206-6310 Screening compound: 4-{4-allyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}phenyl cyclopentyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound Y206-6310
4-{4-allyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}phenyl cyclopentyl 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

Y206-6310

Molecular Formula

C24H27N3OS (C24 H27 N3 OS)

Compound Name

4-{4-allyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}phenyl cyclopentyl ether

IUPAC name

3-[4-(cyclopentyloxy)phenyl]-5-{[(3-methylphenyl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-124-triazole

SMILES

Cc1cccc(CSc2nnc(-c(cc3)ccc3OC3CCCC3)n2CC=C)c1

InChI

InChI=1S/C24H27N3OS/c1-3-15-27-23(20-11-13-22(14-12-20)28-21-9-4-5-10-21)25-26-24(27)29-17-19-8-6-7-18(2)16-19/h3,6-8,11-14,16,21H,1,4-5,9-10,15,17H2,2H3

InChI Key

UDUNVVJPDWXBDZ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.56

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.330

Distribution Coefficient, logD

6.330

Water Solubility, LogSw

-5.60

Polar Surface Area

31.039

Acid Dissociation Constant (pKa)

21.83

Base Dissociation Constant (pKb)

1.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

References: we are preparing a list of scientific research reports with Y206-6310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y206-6310?
Check Price and Availability of Y206-6310, 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 Y206-6310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y206-6310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y206-6310
  • 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 Y206-6310 available by request