M355-0044 Screening compound: 6-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one

M355-0044 Screening compound: 6-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one
M355-0044 Screening compound: 6-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound M355-0044
6-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-2,3-dihydro-1,3-benzoxazol-2-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

M355-0044

Molecular Formula

C20H19N3O3 (C20 H19 N3 O3)

Compound Name

6-[5-(4-tert-butylphenyl)-1,2,4-oxadiazol-3-yl]-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one

IUPAC name

6-[5-(4-tert-butylphenyl)-124-oxadiazol-3-yl]-3-methyl-23-dihydro-13-benzoxazol-2-one

SMILES

CC(C)(C)c(cc1)ccc1-c1nc(-c(cc2)cc(O3)c2N(C)C3=O)no1

InChI

InChI=1S/C20H19N3O3/c1-20(2,3)14-8-5-12(6-9-14)18-21-17(22-26-18)13-7-10-15-16(11-13)25-19(24)23(15)4/h5-11H,1-4H3

InChI Key

MZLDBNDCAFAOSJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27538435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.356

Distribution Coefficient, logD

5.356

Water Solubility, LogSw

-5.41

Polar Surface Area

54.510

Acid Dissociation Constant (pKa)

30.17

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

M355-0044 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with M355-0044 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M355-0044?
Check Price and Availability of M355-0044, 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 M355-0044 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M355-0044
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M355-0044
  • 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 M355-0044 available by request