(1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine
TL;DR: (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine (CAS 324069-50-3) is a chemical compound with molecular formula C12H15NO3S and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxothiolan-3-yl)-1-(4-methoxyphenyl)methanimine
Also Known As: BAS 00777145, (1,1-DIOXO-TETRAHYDRO-THIOPHEN-3-YL)-(4-METHOXY-BENZYLIDENE)-AMINE, N-(1,1-dioxothiolan-3-yl)-1-(4-methoxyphenyl)methanimine, 3-[(1E)-2-(4-methoxyphenyl)-1-azavinyl]thiolane-1,1-dione, (E)-3-((4-methoxybenzylidene)amino)tetrahydrothiophene 1,1-dioxide
| Molecular Formula | C12H15NO3S |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | 1.3012 |
| Topological Polar Surface Area | 55.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.07727 |
| Heavy Atoms | 17 |
| Complexity | 505.05722 |
Chemical Identifiers
| CAS Number | 324069-50-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C=NC2CCS(=O)(=O)C2 |
Product Overview
(1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine (CAS 324069-50-3), with molecular formula C12H15NO3S and molecular weight 253.08 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-1-(4-methoxyphenyl)methanimine.
Chemical Property Profile of (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine
Property Insights of (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine
The XLogP value of 1.3012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine. With a topological polar surface area (TPSA) of 55.73 Ų, (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine has 0 hydrogen bond donor(s) and 4 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 (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine?
The CAS number of (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine is 324069-50-3.
What is the molecular formula of (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine?
The molecular formula of (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine is C12H15NO3S.
What is the molecular weight of (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine?
The molecular weight of (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine is 253.08 g/mol.
Where can I buy (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine?
You can request a quote for (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine?
Yes, KEHONG BIO provides custom synthesis services for (1,1-Dioxo-tetrahydro-thiophen-3-YL)-(4-methoxy-benzylidene)-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.