T964-0135 Screening compound: 2-(4-methoxyphenyl)-3-oxo-2-azaspiro[3.5]nonane-1-carboxylic acid

T964-0135 Screening compound: 2-(4-methoxyphenyl)-3-oxo-2-azaspiro[3.5]nonane-1-carboxylic acid
T964-0135 Screening compound: 2-(4-methoxyphenyl)-3-oxo-2-azaspiro[3.5]nonane-1-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound T964-0135
2-(4-methoxyphenyl)-3-oxo-2-azaspiro[3.5]nonane-1-carboxylic acid

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

T964-0135

Molecular Formula

C16H19NO4 (C16 H19 NO4)

Compound Name

2-(4-methoxyphenyl)-3-oxo-2-azaspiro[3.5]nonane-1-carboxylic acid

IUPAC name

2-(4-methoxyphenyl)-3-oxo-2-azaspiro[3.5]nonane-1-carboxylic acid

SMILES

COc(cc1)ccc1N(C(C12CCCCC2)C(O)=O)C1=O

InChI

InChI=1S/C16H19NO4/c1-21-12-7-5-11(6-8-12)17-13(14(18)19)16(15(17)20)9-3-2-4-10-16/h5-8,13H,2-4,9-10H2,1H3,(H,18,19)/t13-/m0/s1

InChI Key

MMFJQMZLFOYTPF-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD28897833

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.970

Distribution Coefficient, logD

-1.751

Water Solubility, LogSw

-2.31

Polar Surface Area

51.786

Acid Dissociation Constant (pKa)

3.68

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

T964-0135 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Protein-Protein Interaction Library (218420 compounds)

STING Agonist Library (5895 compounds)

Soluble Diversity Library (15920 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators
Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with T964-0135 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T964-0135?
Check Price and Availability of T964-0135, 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 T964-0135 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T964-0135
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T964-0135
  • 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 T964-0135 available by request