M355-0431 Screening compound: 3-ethyl-6-{5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one

M355-0431 Screening compound: 3-ethyl-6-{5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one
M355-0431 Screening compound: 3-ethyl-6-{5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M355-0431
3-ethyl-6-{5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one

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

M355-0431

Molecular Formula

C19H17N3O4 (C19 H17 N3 O4)

Compound Name

3-ethyl-6-{5-[(4-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one

IUPAC name

3-ethyl-6-{5-[(4-methylphenoxy)methyl]-124-oxadiazol-3-yl}-23-dihydro-13-benzoxazol-2-one

SMILES

CCN(c(ccc(-c1noc(COc2ccc(C)cc2)n1)c1)c1O1)C1=O

InChI

InChI=1S/C19H17N3O4/c1-3-22-15-9-6-13(10-16(15)25-19(22)23)18-20-17(26-21-18)11-24-14-7-4-12(2)5-8-14/h4-10H,3,11H2,1-2H3

InChI Key

OWRLCCMINQAUIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27538532

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.36

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.282

Distribution Coefficient, logD

4.282

Water Solubility, LogSw

-4.43

Polar Surface Area

61.634

Acid Dissociation Constant (pKa)

27.91

Base Dissociation Constant (pKb)

-2.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.05

M355-0431 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M355-0431 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M355-0431?
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What is the minimum amount of M355-0431 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M355-0431
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M355-0431
  • 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 M355-0431 available by request