3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide
TL;DR: 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide (CAS 791807-96-0) is a chemical compound with molecular formula C7H12N2OS2 and molecular weight 204.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-morpholin-4-yl-3-sulfanylidenepropanethioamide
Also Known As: 3-(morpholin-4-yl)-3-sulfanylidenepropanethioamide, 3-morpholin-4-yl-3-thioxopropanethioamide, 3-morpholino-3-thioxo-propanethioamide, 3-morpholin-4-yl-3-sulfanylidenepropanethioamide, 1-amino-3-morpholino-1,3-propanedithione
| Molecular Formula | C7H12N2OS2 |
|---|---|
| Molecular Weight | 204.04 g/mol |
| LogP | 0.3222 |
| Topological Polar Surface Area | 38.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.03911 |
| Heavy Atoms | 12 |
| Complexity | 189.8454 |
Chemical Identifiers
| CAS Number | 791807-96-0 |
|---|---|
| SMILES | C1COCCN1C(=S)CC(=S)N |
Product Overview
3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide (CAS 791807-96-0), with molecular formula C7H12N2OS2 and molecular weight 204.04 g/mol. IUPAC: 3-morpholin-4-yl-3-sulfanylidenepropanethioamide.
Chemical Property Profile of 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide
Property Insights of 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide
The XLogP value of 0.3222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide. With a topological polar surface area (TPSA) of 38.49 Ų, 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide has 1 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-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide?
The CAS number of 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide is 791807-96-0.
What is the molecular formula of 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide?
The molecular formula of 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide is C7H12N2OS2.
What is the molecular weight of 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide?
The molecular weight of 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide is 204.04 g/mol.
Where can I buy 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide?
You can request a quote for 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(Morpholin-4-yl)-3-sulfanylidenepropanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.