C528-0828 Screening compound: methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate

C528-0828 Screening compound: methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate
C528-0828 Screening compound: methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound C528-0828
methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate

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

C528-0828

Molecular Formula

C22H22N2O7S (C22 H22 N2 O7 S)

Compound Name

methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate

IUPAC name

methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-13-oxazol-4-yl]methanesulfonyl}acetamido)benzoate

SMILES

Cc1c(CS(CC(Nc(cccc2)c2C(OC)=O)=O)(=O)=O)nc(-c2cc(OC)ccc2)o1

InChI

InChI=1S/C22H22N2O7S/c1-14-19(24-21(31-14)15-7-6-8-16(11-15)29-2)12-32(27,28)13-20(25)23-18-10-5-4-9-17(18)22(26)30-3/h4-11H,12-13H2,1-3H3,(H,23,25)

InChI Key

IFBNYFZALLFRJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14767022

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.49

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.422

Distribution Coefficient, logD

2.380

Water Solubility, LogSw

-3.09

Polar Surface Area

97.558

Acid Dissociation Constant (pKa)

8.39

Base Dissociation Constant (pKb)

-2.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with C528-0828 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C528-0828?
Check Price and Availability of C528-0828, 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 C528-0828 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C528-0828
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C528-0828
  • 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 C528-0828 available by request