Y205-7310 Screening compound: 2-{[4-allyl-5-(4-ethyl-5-methyl-3-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N~1~-benzylacetamide

Y205-7310 Screening compound: 2-{[4-allyl-5-(4-ethyl-5-methyl-3-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N~1~-benzylacetamide
Y205-7310 Screening compound: 2-{[4-allyl-5-(4-ethyl-5-methyl-3-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N~1~-benzylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y205-7310
2-{[4-allyl-5-(4-ethyl-5-methyl-3-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N~1~-benzylacetamide

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

Y205-7310

Molecular Formula

C21H24N4OS2 (C21 H24 N4 OS2)

Compound Name

2-{[4-allyl-5-(4-ethyl-5-methyl-3-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N~1~-benzylacetamide

IUPAC name

N-benzyl-2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-124-triazol-3-yl]sulfanyl}acetamide

SMILES

CCc1c(C)scc1-c(n1CC=C)nnc1SCC(NCc1ccccc1)=O

InChI

InChI=1S/C21H24N4OS2/c1-4-11-25-20(18-13-27-15(3)17(18)5-2)23-24-21(25)28-14-19(26)22-12-16-9-7-6-8-10-16/h4,6-10,13H,1,5,11-12,14H2,2-3H3,(H,22,26)

InChI Key

CCESAKODKVPGIM-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.58

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.526

Distribution Coefficient, logD

4.526

Water Solubility, LogSw

-4.39

Polar Surface Area

49.709

Acid Dissociation Constant (pKa)

13.29

Base Dissociation Constant (pKb)

3.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.57

References: we are preparing a list of scientific research reports with Y205-7310 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y205-7310?
Check Price and Availability of Y205-7310, 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 Y205-7310 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y205-7310
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y205-7310
  • 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 Y205-7310 available by request