Y501-1202 Screening compound: N'-[1-(2,4-dimethoxyphenyl)ethylidene]-2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanohydrazide

Y501-1202 Screening compound: N'-[1-(2,4-dimethoxyphenyl)ethylidene]-2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanohydrazide
Y501-1202 Screening compound: N'-[1-(2,4-dimethoxyphenyl)ethylidene]-2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y501-1202
N'-[1-(2,4-dimethoxyphenyl)ethylidene]-2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanohydrazide

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

Y501-1202

Molecular Formula

C29H32N6O3S (C29 H32 N6 O3 S)

Compound Name

N'-[1-(2,4-dimethoxyphenyl)ethylidene]-2-{[4-phenyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanohydrazide

IUPAC name

N'-[1-(24-dimethoxyphenyl)ethylidene]-2-[(5-{[(4-methylphenyl)amino]methyl}-4-phenyl-4H-124-triazol-3-yl)sulfanyl]propanehydrazide

SMILES

CC(C(NN=C(C)c(ccc(OC)c1)c1OC)=O)Sc1nnc(CNc2ccc(C)cc2)n1-c1ccccc1

InChI

InChI=1S/C29H32N6O3S/c1-19-11-13-22(14-12-19)30-18-27-32-34-29(35(27)23-9-7-6-8-10-23)39-21(3)28(36)33-31-20(2)25-16-15-24(37-4)17-26(25)38-5/h6-17,21,30H,18H2,1-5H3,(H,33,36)/t21-/m0/s1

InChI Key

PJALDTLYUXNAJS-NRFANRHFSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

544.68

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.147

Distribution Coefficient, logD

5.146

Water Solubility, LogSw

-4.93

Polar Surface Area

86.244

Acid Dissociation Constant (pKa)

10.90

Base Dissociation Constant (pKb)

1.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.14

Y501-1202 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with Y501-1202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-1202?
Check Price and Availability of Y501-1202, 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 Y501-1202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-1202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-1202
  • 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 Y501-1202 available by request