T965-0850 Screening compound: 3-(cyclopropylmethoxy)-1-[1-(4-methyl-1,3-oxazole-5-carbonyl)piperidin-4-yl]-7-oxa-1-azaspiro[3.5]nonan-2-one

T965-0850 Screening compound: 3-(cyclopropylmethoxy)-1-[1-(4-methyl-1,3-oxazole-5-carbonyl)piperidin-4-yl]-7-oxa-1-azaspiro[3.5]nonan-2-one
T965-0850 Screening compound: 3-(cyclopropylmethoxy)-1-[1-(4-methyl-1,3-oxazole-5-carbonyl)piperidin-4-yl]-7-oxa-1-azaspiro[3.5]nonan-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T965-0850
3-(cyclopropylmethoxy)-1-[1-(4-methyl-1,3-oxazole-5-carbonyl)piperidin-4-yl]-7-oxa-1-azaspiro[3.5]nonan-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

T965-0850

Molecular Formula

C21H29N3O5 (C21 H29 N3 O5)

Compound Name

3-(cyclopropylmethoxy)-1-[1-(4-methyl-1,3-oxazole-5-carbonyl)piperidin-4-yl]-7-oxa-1-azaspiro[3.5]nonan-2-one

IUPAC name

3-(cyclopropylmethoxy)-1-[1-(4-methyl-13-oxazole-5-carbonyl)piperidin-4-yl]-7-oxa-1-azaspiro[3.5]nonan-2-one

SMILES

Cc1c(C(N(CC2)CCC2N(C2(CCOCC2)C2OCC3CC3)C2=O)=O)ocn1

InChI

InChI=1S/C21H29N3O5/c1-14-17(29-13-22-14)19(25)23-8-4-16(5-9-23)24-20(26)18(28-12-15-2-3-15)21(24)6-10-27-11-7-21/h13,15-16,18H,2-12H2,1H3/t18-/m0/s1

InChI Key

WCIIAUZLQDZWFW-SFHVURJKSA-N

MDL Number (MFCD)

MFCD29016391

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.998

Distribution Coefficient, logD

0.998

Water Solubility, LogSw

-1.30

Polar Surface Area

65.883

Acid Dissociation Constant (pKa)

21.18

Base Dissociation Constant (pKb)

5.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

76.20

T965-0850 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

GPCR Targeted Library (31838 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Anti-HIV1 Library (19540 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T965-0850 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T965-0850?
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What is the minimum amount of T965-0850 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T965-0850
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T965-0850
  • 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 T965-0850 available by request