Y031-8477 Screening compound: N-benzyl-N-(2-hydroxyethyl)-4-methoxy-1-benzenesulfonamide

Y031-8477 Screening compound: N-benzyl-N-(2-hydroxyethyl)-4-methoxy-1-benzenesulfonamide
Y031-8477 Screening compound: N-benzyl-N-(2-hydroxyethyl)-4-methoxy-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-8477
N-benzyl-N-(2-hydroxyethyl)-4-methoxy-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

Y031-8477

Molecular Formula

C16H19NO4S (C16 H19 NO4 S)

Compound Name

N-benzyl-N-(2-hydroxyethyl)-4-methoxy-1-benzenesulfonamide

IUPAC name

N-benzyl-N-(2-hydroxyethyl)-4-methoxybenzene-1-sulfonamide

SMILES

COc(cc1)ccc1S(N(CCO)Cc1ccccc1)(=O)=O

InChI

InChI=1S/C16H19NO4S/c1-21-15-7-9-16(10-8-15)22(19,20)17(11-12-18)13-14-5-3-2-4-6-14/h2-10,18H,11-13H2,1H3

InChI Key

SREBLRNRGKFFJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01212752

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.416

Distribution Coefficient, logD

2.416

Water Solubility, LogSw

-2.43

Polar Surface Area

55.792

Acid Dissociation Constant (pKa)

15.07

Base Dissociation Constant (pKb)

-6.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

Y031-8477 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y031-8477 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-8477?
Check Price and Availability of Y031-8477, 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 Y031-8477 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-8477
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-8477
  • 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 Y031-8477 available by request