S553-0103 Screening compound: 2-{2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl}acetic acid

S553-0103 Screening compound: 2-{2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl}acetic acid
S553-0103 Screening compound: 2-{2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound S553-0103
2-{2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl}acetic 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

S553-0103

Molecular Formula

C10H14N2O4 (C10 H14 N2 O4)

Compound Name

2-{2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl}acetic acid

IUPAC name

2-{24-dioxo-13-diazaspiro[4.5]decan-3-yl}acetic acid

SMILES

OC(CN(C(C1(CCCCC1)N1)=O)C1=O)=O

InChI

InChI=1S/C10H14N2O4/c13-7(14)6-12-8(15)10(11-9(12)16)4-2-1-3-5-10/h1-6H2,(H,11,16)(H,13,14)

InChI Key

CGXTWPOZGXKGOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06363482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

226.23

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

-0.412

Distribution Coefficient, logD

-4.430

Water Solubility, LogSw

-0.85

Polar Surface Area

70.493

Acid Dissociation Constant (pKa)

3.38

Base Dissociation Constant (pKb)

-6.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

70.00

S553-0103 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with S553-0103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S553-0103?
Check Price and Availability of S553-0103, 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 S553-0103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S553-0103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S553-0103
  • 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 S553-0103 available by request