T500-1325 Screening compound: methyl 2-({4-[(4-methoxyphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}amino)acetate

T500-1325 Screening compound: methyl 2-({4-[(4-methoxyphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}amino)acetate
T500-1325 Screening compound: methyl 2-({4-[(4-methoxyphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}amino)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound T500-1325
methyl 2-({4-[(4-methoxyphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}amino)acetate

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

T500-1325

Molecular Formula

C21H30N2O5 (C21 H30 N2 O5)

Compound Name

methyl 2-({4-[(4-methoxyphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}amino)acetate

IUPAC name

methyl 2-({4-[(4-methoxyphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carbonyl}amino)acetate

SMILES

COC(CNC(N(CC1)CCC11OCCC(Cc(cc2)ccc2OC)C1)=O)=O

InChI

InChI=1S/C21H30N2O5/c1-26-18-5-3-16(4-6-18)13-17-7-12-28-21(14-17)8-10-23(11-9-21)20(25)22-15-19(24)27-2/h3-6,17H,7-15H2,1-2H3,(H,22,25)/t17-/m0/s1

InChI Key

BAXSKMFJFQHPJJ-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD30467979

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.496

Distribution Coefficient, logD

2.496

Water Solubility, LogSw

-2.64

Polar Surface Area

61.754

Acid Dissociation Constant (pKa)

15.30

Base Dissociation Constant (pKb)

-0.48

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.90

T500-1325 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 compounds)

Spiro Library (21655 compounds)

Alpha-Helix Mimetics Library (25899 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Cyclic compounds
  • Mimetics
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with T500-1325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T500-1325?
Check Price and Availability of T500-1325, 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 T500-1325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T500-1325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T500-1325
  • 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 T500-1325 available by request