Y501-9151 Screening compound: 2-(3-oxo-1,3-dihydro-1-isobenzofuranyl)-N-phenyl-1-hydrazinecarbothioamide

Y501-9151 Screening compound: 2-(3-oxo-1,3-dihydro-1-isobenzofuranyl)-N-phenyl-1-hydrazinecarbothioamide

Chemical Structure Depiction of ChemDiv screening compound Y501-9151
2-(3-oxo-1,3-dihydro-1-isobenzofuranyl)-N-phenyl-1-hydrazinecarbothioamide

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

Y501-9151

Molecular Formula

C15H13N3O2S (C15 H13 N3 O2 S)

Compound Name

2-(3-oxo-1,3-dihydro-1-isobenzofuranyl)-N-phenyl-1-hydrazinecarbothioamide

IUPAC name

3-[(3-oxo-13-dihydro-2-benzofuran-1-yl)amino]-1-phenylthiourea

SMILES

O=C(c1c2cccc1)OC2NNC(Nc1ccccc1)=S

InChI

InChI=1S/C15H13N3O2S/c19-14-12-9-5-4-8-11(12)13(20-14)17-18-15(21)16-10-6-2-1-3-7-10/h1-9,13,17H,(H2,16,18,21)/t13-/m0/s1

InChI Key

VZTQYSXIXDFZFR-ZDUSSCGKSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.106

Distribution Coefficient, logD

2.069

Water Solubility, LogSw

-3.14

Polar Surface Area

56.284

Acid Dissociation Constant (pKa)

14.19

Base Dissociation Constant (pKb)

6.35

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

6.67

References: we are preparing a list of scientific research reports with Y501-9151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y501-9151?
Check Price and Availability of Y501-9151, 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 Y501-9151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y501-9151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y501-9151
  • 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 Y501-9151 available by request