T964-0161 Screening compound: N-(3-methoxyphenyl)-3-oxo-2-(propan-2-yl)-2-azaspiro[3.4]octane-1-carboxamide

T964-0161 Screening compound: N-(3-methoxyphenyl)-3-oxo-2-(propan-2-yl)-2-azaspiro[3.4]octane-1-carboxamide
T964-0161 Screening compound: N-(3-methoxyphenyl)-3-oxo-2-(propan-2-yl)-2-azaspiro[3.4]octane-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T964-0161
N-(3-methoxyphenyl)-3-oxo-2-(propan-2-yl)-2-azaspiro[3.4]octane-1-carboxamide

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

T964-0161

Molecular Formula

C18H24N2O3 (C18 H24 N2 O3)

Compound Name

N-(3-methoxyphenyl)-3-oxo-2-(propan-2-yl)-2-azaspiro[3.4]octane-1-carboxamide

IUPAC name

N-(3-methoxyphenyl)-3-oxo-2-(propan-2-yl)-2-azaspiro[3.4]octane-1-carboxamide

SMILES

CC(C)N(C(C12CCCC2)C(Nc2cc(OC)ccc2)=O)C1=O

InChI

InChI=1S/C18H24N2O3/c1-12(2)20-15(18(17(20)22)9-4-5-10-18)16(21)19-13-7-6-8-14(11-13)23-3/h6-8,11-12,15H,4-5,9-10H2,1-3H3,(H,19,21)/t15-/m0/s1

InChI Key

KPFDQXRHVQRMCL-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD30468070

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.668

Distribution Coefficient, logD

2.668

Water Solubility, LogSw

-3.07

Polar Surface Area

47.439

Acid Dissociation Constant (pKa)

11.66

Base Dissociation Constant (pKb)

3.84

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

T964-0161 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T964-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T964-0161?
Check Price and Availability of T964-0161, 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 T964-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T964-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T964-0161
  • 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 T964-0161 available by request