4312-0466 Screening compound: 2-oxo-N-(4-sulfamoylphenyl)-2H-chromene-3-carboxamide

4312-0466 Screening compound: 2-oxo-N-(4-sulfamoylphenyl)-2H-chromene-3-carboxamide
4312-0466 Screening compound: 2-oxo-N-(4-sulfamoylphenyl)-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4312-0466
2-oxo-N-(4-sulfamoylphenyl)-2H-chromene-3-carboxamide

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

4312-0466

Molecular Formula

C16H12N2O5S (C16 H12 N2 O5 S)

Compound Name

2-oxo-N-(4-sulfamoylphenyl)-2H-chromene-3-carboxamide

IUPAC name

2-oxo-N-(4-sulfamoylphenyl)-2H-chromene-3-carboxamide

SMILES

NS(c(cc1)ccc1NC(C1=Cc(cccc2)c2OC1=O)=O)(=O)=O

InChI

InChI=1S/C16H12N2O5S/c17-24(21,22)12-7-5-11(6-8-12)18-15(19)13-9-10-3-1-2-4-14(10)23-16(13)20/h1-9H,(H,18,19)(H2,17,21,22)

InChI Key

KBDJGOANWVXJGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00842096

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.35

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.238

Distribution Coefficient, logD

0.967

Water Solubility, LogSw

-1.98

Polar Surface Area

94.854

Acid Dissociation Constant (pKa)

7.46

Base Dissociation Constant (pKb)

-2.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4312-0466 in Drug Discovery

Included in Screening Libraries

Therapeutical Diversity Annotated Library (7563 compounds)

Carbonic Anhydrase II Library (4939 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 4312-0466 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4312-0466?
Check Price and Availability of 4312-0466, 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 4312-0466 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4312-0466
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4312-0466
  • 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 4312-0466 available by request