Y031-0400 Screening compound: 4-methoxy-N-(4-methylpyrimidin-2-yl)benzene-1-sulfonamide

Y031-0400 Screening compound: 4-methoxy-N-(4-methylpyrimidin-2-yl)benzene-1-sulfonamide
Y031-0400 Screening compound: 4-methoxy-N-(4-methylpyrimidin-2-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-0400
4-methoxy-N-(4-methylpyrimidin-2-yl)benzene-1-sulfonamide

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

Y031-0400

Molecular Formula

C12H13N3O3S (C12 H13 N3 O3 S)

Compound Name

4-methoxy-N-(4-methylpyrimidin-2-yl)benzene-1-sulfonamide

IUPAC name

4-methoxy-N-(4-methylpyrimidin-2-yl)benzene-1-sulfonamide

SMILES

Cc1ccnc(NS(c(cc2)ccc2OC)(=O)=O)n1

InChI

InChI=1S/C12H13N3O3S/c1-9-7-8-13-12(14-9)15-19(16,17)11-5-3-10(18-2)4-6-11/h3-8H,1-2H3,(H,13,14,15)

InChI Key

KXKXSCJLIAROCH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05668557

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.467

Distribution Coefficient, logD

0.954

Water Solubility, LogSw

-2.66

Polar Surface Area

68.376

Acid Dissociation Constant (pKa)

7.05

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

Y031-0400 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with Y031-0400 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-0400?
Check Price and Availability of Y031-0400, 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 Y031-0400 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-0400
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-0400
  • 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 Y031-0400 available by request