0672-0371 Screening compound: 2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl methanesulfonate

0672-0371 Screening compound: 2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl methanesulfonate
0672-0371 Screening compound: 2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl methanesulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0672-0371
2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl methanesulfonate

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

0672-0371

Molecular Formula

C13H13NO6S (C13 H13 NO6 S)

Compound Name

2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl methanesulfonate

IUPAC name

2-[(2-oxo-2H-chromen-3-yl)formamido]ethyl methanesulfonate

SMILES

CS(OCCNC(C1=Cc(cccc2)c2OC1=O)=O)(=O)=O

InChI

InChI=1S/C13H13NO6S/c1-21(17,18)19-7-6-14-12(15)10-8-9-4-2-3-5-11(9)20-13(10)16/h2-5,8H,6-7H2,1H3,(H,14,15)

InChI Key

ZLJLJHLDWPGHSN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00416387

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

311.32

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.227

Distribution Coefficient, logD

0.227

Water Solubility, LogSw

-2.10

Polar Surface Area

83.081

Acid Dissociation Constant (pKa)

12.50

Base Dissociation Constant (pKb)

-2.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

0672-0371 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0672-0371 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0672-0371?
Check Price and Availability of 0672-0371, 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 0672-0371 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0672-0371
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0672-0371
  • 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 0672-0371 available by request