Y505-4763 Screening compound: 2-(2,3-dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolane-3-thione

Y505-4763 Screening compound: 2-(2,3-dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolane-3-thione
Y505-4763 Screening compound: 2-(2,3-dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolane-3-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound Y505-4763
2-(2,3-dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolane-3-thione

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

Y505-4763

Molecular Formula

C18H21N3S (C18 H21 N3 S)

Compound Name

2-(2,3-dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolane-3-thione

IUPAC name

n/a

SMILES

CCC(c1ccccc1)(NC1=S)NN1c1c(C)c(C)ccc1

InChI

InChI=1S/C18H21N3S/c1-4-18(15-10-6-5-7-11-15)19-17(22)21(20-18)16-12-8-9-13(2)14(16)3/h5-12,20H,4H2,1-3H3,(H,19,22)/t18-/m0/s1

InChI Key

GEEWVEUUFRCQEK-SFHVURJKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

311.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.959

Distribution Coefficient, logD

4.959

Water Solubility, LogSw

-4.59

Polar Surface Area

28.021

Acid Dissociation Constant (pKa)

15.29

Base Dissociation Constant (pKb)

4.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

7.00

References: we are preparing a list of scientific research reports with Y505-4763 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y505-4763?
Check Price and Availability of Y505-4763, 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 Y505-4763 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y505-4763
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y505-4763
  • 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 Y505-4763 available by request