![3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one structure](/static/products/892/892287-56-8.png)
3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
TL;DR: 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one (CAS 892287-56-8) is a chemical compound with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Also Known As: 3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one, F3071-0005
| Molecular Formula | C13H14ClN3O |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 1.3386 |
| Topological Polar Surface Area | 53.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.08255 |
| Heavy Atoms | 18 |
| Complexity | 503.47256 |
Chemical Identifiers
| CAS Number | 892287-56-8 |
|---|---|
| SMILES | C1CNCCC12NC(=O)C(=N2)C3=CC=C(C=C3)Cl |
Product Overview
3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one (CAS 892287-56-8), with molecular formula C13H14ClN3O and molecular weight 263.08 g/mol. IUPAC: 3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one.
Chemical Property Profile of 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Property Insights of 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
The XLogP value of 1.3386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one. With a topological polar surface area (TPSA) of 53.49 Ų, 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one 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 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one?
The CAS number of 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one is 892287-56-8.
What is the molecular formula of 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one?
The molecular formula of 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one is C13H14ClN3O.
What is the molecular weight of 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one?
The molecular weight of 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one is 263.08 g/mol.
Where can I buy 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one?
You can request a quote for 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.