T687-0679 Screening compound: 4-(morpholinocarbonyl)-8-(3-phenylpropanoyl)-1lambda~6~-thia-8-azaspiro[4.5]decane-1,1-dione

T687-0679 Screening compound: 4-(morpholinocarbonyl)-8-(3-phenylpropanoyl)-1lambda~6~-thia-8-azaspiro[4.5]decane-1,1-dione
T687-0679 Screening compound: 4-(morpholinocarbonyl)-8-(3-phenylpropanoyl)-1lambda~6~-thia-8-azaspiro[4.5]decane-1,1-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound T687-0679
4-(morpholinocarbonyl)-8-(3-phenylpropanoyl)-1lambda~6~-thia-8-azaspiro[4.5]decane-1,1-dione

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

T687-0679

Molecular Formula

C22H30N2O5S (C22 H30 N2 O5 S)

Compound Name

4-(morpholinocarbonyl)-8-(3-phenylpropanoyl)-1lambda~6~-thia-8-azaspiro[4.5]decane-1,1-dione

IUPAC name

n/a

SMILES

O=C(CCc1ccccc1)N(CC1)CCC1(C(CC1)C(N2CCOCC2)=O)S1(=O)=O

InChI

InChI=1S/C22H30N2O5S/c25-20(7-6-18-4-2-1-3-5-18)23-11-9-22(10-12-23)19(8-17-30(22,27)28)21(26)24-13-15-29-16-14-24/h1-5,19H,6-17H2/t19-/m0/s1

InChI Key

ACRVJCVKVZLUDR-IBGZPJMESA-N

MDL Number (MFCD)

MFCD30465025

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.56

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.677

Distribution Coefficient, logD

0.677

Water Solubility, LogSw

-1.90

Polar Surface Area

69.728

Acid Dissociation Constant (pKa)

19.25

Base Dissociation Constant (pKb)

-1.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.60

T687-0679 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with T687-0679 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T687-0679?
Check Price and Availability of T687-0679, 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 T687-0679 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T687-0679
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T687-0679
  • 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 T687-0679 available by request