Y032-3654 Screening compound: 1-(4-methylphenyl)-N-(5-nitro-1,3-thiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide

Y032-3654 Screening compound: 1-(4-methylphenyl)-N-(5-nitro-1,3-thiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide
Y032-3654 Screening compound: 1-(4-methylphenyl)-N-(5-nitro-1,3-thiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-3654
1-(4-methylphenyl)-N-(5-nitro-1,3-thiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide

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

Y032-3654

Molecular Formula

C15H14N4O4S (C15 H14 N4 O4 S)

Compound Name

1-(4-methylphenyl)-N-(5-nitro-1,3-thiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide

IUPAC name

1-(4-methylphenyl)-N-(5-nitro-13-thiazol-2-yl)-5-oxopyrrolidine-3-carboxamide

SMILES

Cc(cc1)ccc1N(CC(C1)C(Nc2ncc([N+]([O-])=O)s2)=O)C1=O

InChI

InChI=1S/C15H14N4O4S/c1-9-2-4-11(5-3-9)18-8-10(6-12(18)20)14(21)17-15-16-7-13(24-15)19(22)23/h2-5,7,10H,6,8H2,1H3,(H,16,17,21)/t10-/m0/s1

InChI Key

WIVBWTCSGYLKIE-JTQLQIEISA-N

MDL Number (MFCD)

MFCD05996785

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.672

Distribution Coefficient, logD

0.600

Water Solubility, LogSw

-2.94

Polar Surface Area

84.381

Acid Dissociation Constant (pKa)

5.33

Base Dissociation Constant (pKb)

-0.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.67

Y032-3654 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y032-3654 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-3654?
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What is the minimum amount of Y032-3654 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-3654
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-3654
  • 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 Y032-3654 available by request