E773-0118 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-[5-methyl-4-(phenoxymethyl)-1,3-oxazol-2-yl]benzamide

E773-0118 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-[5-methyl-4-(phenoxymethyl)-1,3-oxazol-2-yl]benzamide
E773-0118 Screening compound: N-(5-chloro-2-methoxyphenyl)-4-[5-methyl-4-(phenoxymethyl)-1,3-oxazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E773-0118
N-(5-chloro-2-methoxyphenyl)-4-[5-methyl-4-(phenoxymethyl)-1,3-oxazol-2-yl]benzamide

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

E773-0118

Molecular Formula

C25H21ClN2O4 (C25 H21 ClN2 O4)

Compound Name

N-(5-chloro-2-methoxyphenyl)-4-[5-methyl-4-(phenoxymethyl)-1,3-oxazol-2-yl]benzamide

IUPAC name

N-(5-chloro-2-methoxyphenyl)-4-[5-methyl-4-(phenoxymethyl)-13-oxazol-2-yl]benzamide

SMILES

Cc1c(COc2ccccc2)nc(-c(cc2)ccc2C(Nc(cc(cc2)Cl)c2OC)=O)o1

InChI

InChI=1S/C25H21ClN2O4/c1-16-22(15-31-20-6-4-3-5-7-20)28-25(32-16)18-10-8-17(9-11-18)24(29)27-21-14-19(26)12-13-23(21)30-2/h3-14H,15H2,1-2H3,(H,27,29)

InChI Key

YJWUTJFPURCJPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14917525

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.91

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.347

Distribution Coefficient, logD

5.242

Water Solubility, LogSw

-5.92

Polar Surface Area

55.612

Acid Dissociation Constant (pKa)

7.97

Base Dissociation Constant (pKb)

-1.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

E773-0118 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E773-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E773-0118?
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What is the minimum amount of E773-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E773-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E773-0118
  • 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 E773-0118 available by request