Y032-3959 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)propanamide

Y032-3959 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)propanamide
Y032-3959 Screening compound: 3-[(4-chlorophenyl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-3959
3-[(4-chlorophenyl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)propanamide

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

Y032-3959

Molecular Formula

C12H10ClN3O3S2 (C12 H10 ClN3 O3 S2)

Compound Name

3-[(4-chlorophenyl)sulfanyl]-N-(5-nitro-1,3-thiazol-2-yl)propanamide

IUPAC name

3-[(4-chlorophenyl)sulfanyl]-N-(5-nitro-13-thiazol-2-yl)propanamide

SMILES

[O-][N+](c1cnc(NC(CCSc(cc2)ccc2Cl)=O)s1)=O

InChI

InChI=1S/C12H10ClN3O3S2/c13-8-1-3-9(4-2-8)20-6-5-10(17)15-12-14-7-11(21-12)16(18)19/h1-4,7H,5-6H2,(H,14,15,17)

InChI Key

CSAZHDHVWMTJDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07067965

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.81

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.169

Distribution Coefficient, logD

2.866

Water Solubility, LogSw

-4.54

Polar Surface Area

67.417

Acid Dissociation Constant (pKa)

6.12

Base Dissociation Constant (pKb)

-3.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

Y032-3959 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y032-3959 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-3959?
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What is the minimum amount of Y032-3959 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-3959
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-3959
  • 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 Y032-3959 available by request