Y032-1835 Screening compound: N-[5-(tert-butyl)-1,3,4-thiadiazol-2-yl]-4-nitro-1-benzenesulfonamide

Y032-1835 Screening compound: N-[5-(tert-butyl)-1,3,4-thiadiazol-2-yl]-4-nitro-1-benzenesulfonamide
Y032-1835 Screening compound: N-[5-(tert-butyl)-1,3,4-thiadiazol-2-yl]-4-nitro-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y032-1835
N-[5-(tert-butyl)-1,3,4-thiadiazol-2-yl]-4-nitro-1-benzenesulfonamide

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

Y032-1835

Molecular Formula

C12H14N4O4S2 (C12 H14 N4 O4 S2)

Compound Name

N-[5-(tert-butyl)-1,3,4-thiadiazol-2-yl]-4-nitro-1-benzenesulfonamide

IUPAC name

N-(5-tert-butyl-134-thiadiazol-2-yl)-4-nitrobenzene-1-sulfonamide

SMILES

CC(C)(C)c1nnc(NS(c(cc2)ccc2[N+]([O-])=O)(=O)=O)s1

InChI

InChI=1S/C12H14N4O4S2/c1-12(2,3)10-13-14-11(21-10)15-22(19,20)9-6-4-8(5-7-9)16(17)18/h4-7H,1-3H3,(H,14,15)

InChI Key

WIWRVTXHWSPXQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03144675

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.109

Distribution Coefficient, logD

-1.015

Water Solubility, LogSw

-3.55

Polar Surface Area

97.814

Acid Dissociation Constant (pKa)

3.28

Base Dissociation Constant (pKb)

-2.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

Y032-1835 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

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 Y032-1835 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y032-1835?
Check Price and Availability of Y032-1835, 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 Y032-1835 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y032-1835
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y032-1835
  • 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 Y032-1835 available by request