E773-0540 Screening compound: 1-benzyl-4-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzoyl)piperazine

E773-0540 Screening compound: 1-benzyl-4-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzoyl)piperazine
E773-0540 Screening compound: 1-benzyl-4-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound E773-0540
1-benzyl-4-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzoyl)piperazine

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

E773-0540

Molecular Formula

C30H31N3O3 (C30 H31 N3 O3)

Compound Name

1-benzyl-4-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl}benzoyl)piperazine

IUPAC name

1-benzyl-4-(4-{5-methyl-4-[(4-methylphenoxy)methyl]-13-oxazol-2-yl}benzoyl)piperazine

SMILES

Cc1c(COc2ccc(C)cc2)nc(-c(cc2)ccc2C(N2CCN(Cc3ccccc3)CC2)=O)o1

InChI

InChI=1S/C30H31N3O3/c1-22-8-14-27(15-9-22)35-21-28-23(2)36-29(31-28)25-10-12-26(13-11-25)30(34)33-18-16-32(17-19-33)20-24-6-4-3-5-7-24/h3-15H,16-21H2,1-2H3

InChI Key

WLVQVOLSSGOIFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14917665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

481.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.745

Distribution Coefficient, logD

4.729

Water Solubility, LogSw

-4.44

Polar Surface Area

45.777

Acid Dissociation Constant (pKa)

28.54

Base Dissociation Constant (pKb)

5.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

E773-0540 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

CNS Targets (44014 compounds)

PD-1/L1 Library (498 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Cancer
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with E773-0540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E773-0540?
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What is the minimum amount of E773-0540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E773-0540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E773-0540
  • 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 E773-0540 available by request