E773-0355 Screening compound: methyl 2-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzamido)benzoate

E773-0355 Screening compound: methyl 2-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzamido)benzoate
E773-0355 Screening compound: methyl 2-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E773-0355
methyl 2-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzamido)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

E773-0355

Molecular Formula

C27H24N2O5 (C27 H24 N2 O5)

Compound Name

methyl 2-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzamido)benzoate

IUPAC name

methyl 2-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-13-oxazol-2-yl}benzamido)benzoate

SMILES

Cc1c(COc2ccc(C)cc2)nc(-c(cc2)ccc2C(Nc(cccc2)c2C(OC)=O)=O)o1

InChI

InChI=1S/C27H24N2O5/c1-17-8-14-21(15-9-17)33-16-24-18(2)34-26(29-24)20-12-10-19(11-13-20)25(30)28-23-7-5-4-6-22(23)27(31)32-3/h4-15H,16H2,1-3H3,(H,28,30)

InChI Key

CCKFAWBXAWIHPW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14917594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.270

Distribution Coefficient, logD

4.961

Water Solubility, LogSw

-5.16

Polar Surface Area

69.155

Acid Dissociation Constant (pKa)

7.38

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

E773-0355 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E773-0355 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E773-0355?
Check Price and Availability of E773-0355, 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 E773-0355 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E773-0355
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E773-0355
  • 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 E773-0355 available by request