Y070-0256 Screening compound: (2E)-3-(4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}prop-2-enamide

Y070-0256 Screening compound: (2E)-3-(4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}prop-2-enamide
Y070-0256 Screening compound: (2E)-3-(4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-0256
(2E)-3-(4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}prop-2-enamide

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

Y070-0256

Molecular Formula

C19H17N3O3S2 (C19 H17 N3 O3 S2)

Compound Name

(2E)-3-(4-methylphenyl)-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}prop-2-enamide

IUPAC name

(2E)-3-(4-methylphenyl)-N-{4-[(13-thiazol-2-yl)sulfamoyl]phenyl}prop-2-enamide

SMILES

Cc1ccc(/C=C/C(Nc(cc2)ccc2S(Nc2nccs2)(=O)=O)=O)cc1

InChI

InChI=1S/C19H17N3O3S2/c1-14-2-4-15(5-3-14)6-11-18(23)21-16-7-9-17(10-8-16)27(24,25)22-19-20-12-13-26-19/h2-13H,1H3,(H,20,22)(H,21,23)

InChI Key

QHBOLETWBUDYPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01458785

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.811

Distribution Coefficient, logD

3.402

Water Solubility, LogSw

-3.96

Polar Surface Area

74.244

Acid Dissociation Constant (pKa)

7.20

Base Dissociation Constant (pKb)

-0.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

Y070-0256 in Drug Discovery

Included in Screening Libraries

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with Y070-0256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-0256?
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What is the minimum amount of Y070-0256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-0256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-0256
  • 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 Y070-0256 available by request