6646-0024 Screening compound: methyl 2-(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate

6646-0024 Screening compound: methyl 2-(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate
6646-0024 Screening compound: methyl 2-(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6646-0024
methyl 2-(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate

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

6646-0024

Molecular Formula

C10H8ClNO4 (C10 H8 ClNO4)

Compound Name

methyl 2-(5-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)acetate

IUPAC name

methyl 2-(5-chloro-2-oxo-23-dihydro-13-benzoxazol-3-yl)acetate

SMILES

COC(CN(c(cc(cc1)Cl)c1O1)C1=O)=O

InChI

InChI=1S/C10H8ClNO4/c1-15-9(13)5-12-7-4-6(11)2-3-8(7)16-10(12)14/h2-4H,5H2,1H3

InChI Key

ZLSRVVWTDNQNHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02325342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

241.63

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.679

Distribution Coefficient, logD

1.679

Water Solubility, LogSw

-2.58

Polar Surface Area

43.917

Acid Dissociation Constant (pKa)

20.65

Base Dissociation Constant (pKb)

-4.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

6646-0024 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 6646-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6646-0024?
Check Price and Availability of 6646-0024, 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 6646-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6646-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6646-0024
  • 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 6646-0024 available by request