F064-0005 Screening compound: methyl 2-{6-[(4-acetylphenyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate

F064-0005 Screening compound: methyl 2-{6-[(4-acetylphenyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate
F064-0005 Screening compound: methyl 2-{6-[(4-acetylphenyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound F064-0005
methyl 2-{6-[(4-acetylphenyl)sulfamoyl]-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

F064-0005

Molecular Formula

C18H16N2O7S (C18 H16 N2 O7 S)

Compound Name

methyl 2-{6-[(4-acetylphenyl)sulfamoyl]-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl}acetate

IUPAC name

methyl 2-{6-[(4-acetylphenyl)sulfamoyl]-2-oxo-23-dihydro-13-benzoxazol-3-yl}acetate

SMILES

CC(c(cc1)ccc1NS(c(cc1)cc(O2)c1N(CC(OC)=O)C2=O)(=O)=O)=O

InChI

InChI=1S/C18H16N2O7S/c1-11(21)12-3-5-13(6-4-12)19-28(24,25)14-7-8-15-16(9-14)27-18(23)20(15)10-17(22)26-2/h3-9,19H,10H2,1-2H3

InChI Key

SIVAJOLXKCIHSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27097864

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.4

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.446

Distribution Coefficient, logD

1.365

Water Solubility, LogSw

-2.59

Polar Surface Area

98.394

Acid Dissociation Constant (pKa)

8.09

Base Dissociation Constant (pKb)

-6.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with F064-0005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F064-0005?
Check Price and Availability of F064-0005, 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 F064-0005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F064-0005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F064-0005
  • 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 F064-0005 available by request