S380-0092 Screening compound: 2-(2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)-N~1~-isopropylacetamide
Chemical Structure Depiction of ChemDiv screening compound S380-0092
2-(2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)-N~1~-isopropylacetamide
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
S380-0092
Molecular Formula
C13H21N3O3 (C13 H21 N3 O3)
Compound Name
2-(2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)-N~1~-isopropylacetamide
IUPAC name
2-{24-dioxo-13-diazaspiro[4.5]decan-3-yl}-N-(propan-2-yl)acetamide
SMILES
CC(C)NC(CN(C(C1(CCCCC1)N1)=O)C1=O)=O
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
267.33
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
6
Partition Coefficient, logP
0.819
Distribution Coefficient, logD
0.819
Water Solubility, LogSw
-1.60
Polar Surface Area
65.554
Acid Dissociation Constant (pKa)
11.13
Base Dissociation Constant (pKb)
5.63
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
76.92
S380-0092 in Drug Discovery
Included in Screening Libraries
3D-Fragment Library (4274 compounds)
Protein-Protein Interaction Library (218420 compounds)
Spiro Library (21655 compounds)
Beyond the Flatland Library sp3 enriched (92988 compounds)
MDM2-p53 interaction inhibitors Library (21687 compounds)
Included in 1.7M Stock Database
- 3D
- Fragments
- Cyclic compounds
- Cyclic compounds
- PPI modulators
- PPI modulators
- PPI modulators
- Cancer
References: we are preparing a list of scientific research reports with S380-0092 chemical compound. It will be published here after verification.
Frequently Asked Questions
Check Price and Availability of S380-0092, 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.
Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)