4-Pentanethioylmorpholine
TL;DR: 4-Pentanethioylmorpholine (CAS 2832-99-7) is a chemical compound with molecular formula C9H17NOS and molecular weight 187.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-morpholin-4-ylpentane-1-thione
Also Known As: 4-Pentanethioylmorpholine, N-Thio-valero-morpholine, 4-Pentanethioylmorpholine #, 1-morpholin-4-ylpentane-1-thione, Morpholine, 4-(1-thioxopentyl)-
| Molecular Formula | C9H17NOS |
|---|---|
| Molecular Weight | 187.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 44.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 187.10309 |
| Heavy Atoms | 12 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 2832-99-7 |
|---|---|
| SMILES | CCCCC(=S)N1CCOCC1 |
| InChIKey | DFRGWSXQFVGFQL-UHFFFAOYSA-N |
Product Overview
4-Pentanethioylmorpholine (CAS 2832-99-7), with molecular formula C9H17NOS and molecular weight 187.10 g/mol. IUPAC: 1-morpholin-4-ylpentane-1-thione.
Chemical Property Profile of 4-Pentanethioylmorpholine
Property Insights of 4-Pentanethioylmorpholine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pentanethioylmorpholine. With a topological polar surface area (TPSA) of 44.6 Ų, 4-Pentanethioylmorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pentanethioylmorpholine has 0 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 4-Pentanethioylmorpholine?
The CAS number of 4-Pentanethioylmorpholine is 2832-99-7.
What is the molecular formula of 4-Pentanethioylmorpholine?
The molecular formula of 4-Pentanethioylmorpholine is C9H17NOS.
What is the molecular weight of 4-Pentanethioylmorpholine?
The molecular weight of 4-Pentanethioylmorpholine is 187.10 g/mol.
Where can I buy 4-Pentanethioylmorpholine?
You can request a quote for 4-Pentanethioylmorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pentanethioylmorpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-Pentanethioylmorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.