Morpholine, 4-benzylthiocarbonyl-
TL;DR: Morpholine, 4-benzylthiocarbonyl- (CAS 56368-47-9) is a chemical compound with molecular formula C12H15NO2S and molecular weight 237.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-benzyl morpholine-4-carbothioate
Also Known As: Phenylthioacetomorpholide, Morpholine, 4-benzylthiocarbonyl-, S-benzyl morpholine-4-carbothioate, Morpholine, 4-(phenylthioacetyl)-, morpholine-4-carbothioic acid S-benzyl ester
| Molecular Formula | C12H15NO2S |
|---|---|
| Molecular Weight | 237.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 54.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.08235 |
| Heavy Atoms | 16 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 56368-47-9 |
|---|---|
| SMILES | C1COCCN1C(=O)SCC2=CC=CC=C2 |
| InChIKey | XYHPCPRPHCVTGF-UHFFFAOYSA-N |
Product Overview
Morpholine, 4-benzylthiocarbonyl- (CAS 56368-47-9), with molecular formula C12H15NO2S and molecular weight 237.08 g/mol. IUPAC: S-benzyl morpholine-4-carbothioate.
Chemical Property Profile of Morpholine, 4-benzylthiocarbonyl-
Property Insights of Morpholine, 4-benzylthiocarbonyl-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Morpholine, 4-benzylthiocarbonyl-. With a topological polar surface area (TPSA) of 54.8 Ų, Morpholine, 4-benzylthiocarbonyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Morpholine, 4-benzylthiocarbonyl- has 0 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 Morpholine, 4-benzylthiocarbonyl-?
The CAS number of Morpholine, 4-benzylthiocarbonyl- is 56368-47-9.
What is the molecular formula of Morpholine, 4-benzylthiocarbonyl-?
The molecular formula of Morpholine, 4-benzylthiocarbonyl- is C12H15NO2S.
What is the molecular weight of Morpholine, 4-benzylthiocarbonyl-?
The molecular weight of Morpholine, 4-benzylthiocarbonyl- is 237.08 g/mol.
Where can I buy Morpholine, 4-benzylthiocarbonyl-?
You can request a quote for Morpholine, 4-benzylthiocarbonyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Morpholine, 4-benzylthiocarbonyl-?
Yes, KEHONG BIO provides custom synthesis services for Morpholine, 4-benzylthiocarbonyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.