M466-1120 Screening compound: 2-phenyl-N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]butanamide

M466-1120 Screening compound: 2-phenyl-N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]butanamide
M466-1120 Screening compound: 2-phenyl-N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M466-1120
2-phenyl-N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]butanamide

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

M466-1120

Molecular Formula

C17H16N2O2S (C17 H16 N2 O2 S)

Compound Name

2-phenyl-N-[3-(thiophen-3-yl)-1,2-oxazol-5-yl]butanamide

IUPAC name

2-phenyl-N-[3-(thiophen-3-yl)-12-oxazol-5-yl]butanamide

SMILES

CCC(C(Nc1cc(-c2cscc2)no1)=O)c1ccccc1

InChI

InChI=1S/C17H16N2O2S/c1-2-14(12-6-4-3-5-7-12)17(20)18-16-10-15(19-21-16)13-8-9-22-11-13/h3-11,14H,2H2,1H3,(H,18,20)/t14-/m1/s1

InChI Key

NEZZRVZVSYIGIT-CQSZACIVSA-N

MDL Number (MFCD)

MFCD27543725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.245

Distribution Coefficient, logD

4.243

Water Solubility, LogSw

-4.17

Polar Surface Area

46.629

Acid Dissociation Constant (pKa)

9.73

Base Dissociation Constant (pKb)

-5.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

17.60

M466-1120 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 M466-1120 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M466-1120?
Check Price and Availability of M466-1120, 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 M466-1120 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M466-1120
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M466-1120
  • 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 M466-1120 available by request