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9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione
TL;DR: 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione (CAS 19035-79-1) is a chemical compound with molecular formula C16H20N2O2 and molecular weight 272.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione
Also Known As: 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione, H-Asn-OtBu, 2,5-Disulfobenzaldehyde, 3,9-Diazaspiro[5.5]undecane-2,4-dione, 9-(phenylmethyl)-, 9-BENZYL-3,9-DIAZA-SPIRO[5.5]UNDECANE-2,4-DIONE
| Molecular Formula | C16H20N2O2 |
|---|---|
| Molecular Weight | 272.15 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.15247 |
| Heavy Atoms | 20 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 19035-79-1 |
|---|---|
| SMILES | C1CN(CCC12CC(=O)NC(=O)C2)CC3=CC=CC=C3 |
| InChIKey | MZOUQZZYZKEBKL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione (CAS 19035-79-1), with molecular formula C16H20N2O2 and molecular weight 272.15 g/mol. IUPAC: 9-benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione.
Chemical Property Profile of 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione
Property Insights of 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione. With a topological polar surface area (TPSA) of 49.4 Ų, 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione?
The CAS number of 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione is 19035-79-1.
What is the molecular formula of 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione?
The molecular formula of 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione is C16H20N2O2.
What is the molecular weight of 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione?
The molecular weight of 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione is 272.15 g/mol.
Where can I buy 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione?
You can request a quote for 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 9-Benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.