0634-0076 Screening compound: 4-[(1E)-2-PHENYLETHENESULFONAMIDO]BUTANOIC ACID

0634-0076 Screening compound: 4-[(1E)-2-PHENYLETHENESULFONAMIDO]BUTANOIC ACID
0634-0076 Screening compound: 4-[(1E)-2-PHENYLETHENESULFONAMIDO]BUTANOIC ACID alternative view

Chemical Structure Depiction of ChemDiv screening compound 0634-0076
4-[(1E)-2-PHENYLETHENESULFONAMIDO]BUTANOIC ACID

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

0634-0076

Molecular Formula

C12H15NO4S (C12 H15 NO4 S)

Compound Name

4-[(1E)-2-PHENYLETHENESULFONAMIDO]BUTANOIC ACID

IUPAC name

n/a

SMILES

OC(CCCNS(/C=C/c1ccccc1)(=O)=O)=O

InChI

InChI=1S/C12H15NO4S/c14-12(15)7-4-9-13-18(16,17)10-8-11-5-2-1-3-6-11/h1-3,5-6,8,10,13H,4,7,9H2,(H,14,15)

InChI Key

OATMKNVNERJQCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00181525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.32

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.094

Distribution Coefficient, logD

-1.734

Water Solubility, LogSw

-1.96

Polar Surface Area

72.121

Acid Dissociation Constant (pKa)

4.57

Base Dissociation Constant (pKb)

-5.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

0634-0076 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Pool

References: we are preparing a list of scientific research reports with 0634-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0634-0076?
Check Price and Availability of 0634-0076, 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 0634-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0634-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0634-0076
  • 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 0634-0076 available by request