![3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione structure](/static/products/595/5955-39-5.png)
3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione
TL;DR: 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione (CAS 5955-39-5) is a chemical compound with molecular formula C13H14N2S and molecular weight 230.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione
Also Known As: 3-phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione, ChemDiv3_008593, IDI1_026503, 3-Phenyl-1,4-diazaspiro4.4non-3-ene-2-thione, 8-phenyl-6,9-diazaspiro[4.4]non-8-ene-7-thione
| Molecular Formula | C13H14N2S |
|---|---|
| Molecular Weight | 230.09 g/mol |
| LogP | 2.6766 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.08777 |
| Heavy Atoms | 16 |
| Complexity | 444.26022 |
Chemical Identifiers
| CAS Number | 5955-39-5 |
|---|---|
| SMILES | C1CCC2(C1)NC(=S)C(=N2)C3=CC=CC=C3 |
Product Overview
3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione (CAS 5955-39-5), with molecular formula C13H14N2S and molecular weight 230.09 g/mol. IUPAC: 3-phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione.
Chemical Property Profile of 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione
Property Insights of 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione
The XLogP value of 2.6766 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione. With a topological polar surface area (TPSA) of 24.39 Ų, 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione has 1 hydrogen bond donor(s) and 2 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-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione?
The CAS number of 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione is 5955-39-5.
What is the molecular formula of 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione?
The molecular formula of 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione is C13H14N2S.
What is the molecular weight of 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione?
The molecular weight of 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione is 230.09 g/mol.
Where can I buy 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione?
You can request a quote for 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-1,4-diazaspiro[4.4]non-3-ene-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.