1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-
TL;DR: 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)- (CAS 28936-94-9) is a chemical compound with molecular formula C14H17N3O2 and molecular weight 259.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-benzyl-1,3,8-triazaspiro[4.5]decane-2,4-dione
Also Known As: 8-Benzyl-1,3,8-triazaspiro[4.5]decane-2,4-dione, null, 1,3,8-Triazaspiro[4.5]decane-2,4-dione, 8-(phenylmethyl)-, 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-, 5-26-05-00397 (Beilstein Handbook Reference)
| Molecular Formula | C14H17N3O2 |
|---|---|
| Molecular Weight | 259.13 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.13208 |
| Heavy Atoms | 19 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 28936-94-9 |
|---|---|
| SMILES | C1CN(CCC12C(=O)NC(=O)N2)CC3=CC=CC=C3 |
| InChIKey | ISFXLJGTXHSNDU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)- (CAS 28936-94-9), with molecular formula C14H17N3O2 and molecular weight 259.13 g/mol. IUPAC: 8-benzyl-1,3,8-triazaspiro[4.5]decane-2,4-dione.
Chemical Property Profile of 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-
Property Insights of 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-. Following Lipinski's Rule of Five, 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)- has 2 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 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-?
The CAS number of 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)- is 28936-94-9.
What is the molecular formula of 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-?
The molecular formula of 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)- is C14H17N3O2.
What is the molecular weight of 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-?
The molecular weight of 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)- is 259.13 g/mol.
Where can I buy 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-?
You can request a quote for 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,8-Triazaspiro(4.5)decane-2,4-dione, 8-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.