SA46-0202 Screening compound: 2-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-7-(pyrrolidin-1-yl)-5-oxa-2-azaspiro[3.4]octane

SA46-0202 Screening compound: 2-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-7-(pyrrolidin-1-yl)-5-oxa-2-azaspiro[3.4]octane
SA46-0202 Screening compound: 2-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-7-(pyrrolidin-1-yl)-5-oxa-2-azaspiro[3.4]octane alternative view

Chemical Structure Depiction of ChemDiv screening compound SA46-0202
2-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-7-(pyrrolidin-1-yl)-5-oxa-2-azaspiro[3.4]octane

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

SA46-0202

Molecular Formula

C16H23N3O3 (C16 H23 N3 O3)

Compound Name

2-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-7-(pyrrolidin-1-yl)-5-oxa-2-azaspiro[3.4]octane

IUPAC name

2-(35-dimethyl-12-oxazole-4-carbonyl)-7-(pyrrolidin-1-yl)-5-oxa-2-azaspiro[3.4]octane

SMILES

Cc1noc(C)c1C(N(C1)CC1(C1)OCC1N1CCCC1)=O

InChI

InChI=1S/C16H23N3O3/c1-11-14(12(2)22-17-11)15(20)19-9-16(10-19)7-13(8-21-16)18-5-3-4-6-18/h13H,3-10H2,1-2H3/t13-/m1/s1

InChI Key

NDSCASRDQIOCTP-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD32236481

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.38

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

0.645

Distribution Coefficient, logD

-0.610

Water Solubility, LogSw

-0.68

Polar Surface Area

50.048

Acid Dissociation Constant (pKa)

27.39

Base Dissociation Constant (pKb)

8.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

75.00

SA46-0202 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with SA46-0202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA46-0202?
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What is the minimum amount of SA46-0202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA46-0202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA46-0202
  • 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 SA46-0202 available by request