(3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide
TL;DR: (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide (CAS 1728-18-3) is a chemical compound with molecular formula C13H15NO3S and molecular weight 265.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide
Also Known As: Morpholine, S,S-dioxide, (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide, (3Z)-3-(morpholinomethylene)benzothiophene 1,1-dioxide, 4-[(1,1-dioxido-1-benzothiophen-3(2h)-ylidene)methyl]morpholine, Morpholine, 4-((2,3-dihydrobenzo(b)thien-3-ylidene)methyl)-, S,S-dioxide
| Molecular Formula | C13H15NO3S |
|---|---|
| Molecular Weight | 265.08 g/mol |
| LogP | 1.147 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 265.07727 |
| Heavy Atoms | 18 |
| Complexity | 586.00885 |
Chemical Identifiers
| CAS Number | 1728-18-3 |
|---|---|
| SMILES | C1COCCN1/C=C/2\CS(=O)(=O)C3=CC=CC=C23 |
Product Overview
(3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide (CAS 1728-18-3), with molecular formula C13H15NO3S and molecular weight 265.08 g/mol. IUPAC: (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide.
Chemical Property Profile of (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide
Property Insights of (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide
The XLogP value of 1.147 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide. With a topological polar surface area (TPSA) of 46.61 Ų, (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide 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 (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide?
The CAS number of (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide is 1728-18-3.
What is the molecular formula of (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide?
The molecular formula of (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide is C13H15NO3S.
What is the molecular weight of (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide?
The molecular weight of (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide is 265.08 g/mol.
Where can I buy (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide?
You can request a quote for (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-3-(morpholin-4-ylmethylidene)-1-benzothiophene 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.