SC04-0300 Screening compound: (3,5-dimethyl-4-isoxazolyl){3-[2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methanone

SC04-0300 Screening compound: (3,5-dimethyl-4-isoxazolyl){3-[2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methanone
SC04-0300 Screening compound: (3,5-dimethyl-4-isoxazolyl){3-[2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC04-0300
(3,5-dimethyl-4-isoxazolyl){3-[2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methanone

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

SC04-0300

Molecular Formula

C21H24N4O4 (C21 H24 N4 O4)

Compound Name

(3,5-dimethyl-4-isoxazolyl){3-[2-(5-phenyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methanone

IUPAC name

1-(35-dimethyl-12-oxazole-4-carbonyl)-3-[2-(5-phenyl-124-oxadiazol-3-yl)ethoxy]piperidine

SMILES

Cc1noc(C)c1C(N(CCC1)CC1OCCc1noc(-c2ccccc2)n1)=O

InChI

InChI=1S/C21H24N4O4/c1-14-19(15(2)28-23-14)21(26)25-11-6-9-17(13-25)27-12-10-18-22-20(29-24-18)16-7-4-3-5-8-16/h3-5,7-8,17H,6,9-13H2,1-2H3/t17-/m0/s1

InChI Key

RANUOJGEIPQCKW-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD32253122

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.278

Distribution Coefficient, logD

2.278

Water Solubility, LogSw

-2.36

Polar Surface Area

78.186

Acid Dissociation Constant (pKa)

26.65

Base Dissociation Constant (pKb)

-1.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.86

SC04-0300 in Drug Discovery

Included in Screening Libraries

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

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC04-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC04-0300?
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What is the minimum amount of SC04-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC04-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC04-0300
  • 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 SC04-0300 available by request