4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine
TL;DR: 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine (CAS 339279-01-5) is a chemical compound with molecular formula C16H19N3OS and molecular weight 301.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]thiomorpholine
Also Known As: 4L-557S, 4-[6-(methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine, 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]thiomorpholine
| Molecular Formula | C16H19N3OS |
|---|---|
| Molecular Weight | 301.12 g/mol |
| LogP | 2.8432 |
| Topological Polar Surface Area | 38.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.12488 |
| Heavy Atoms | 21 |
| Complexity | 585.3309 |
Chemical Identifiers
| CAS Number | 339279-01-5 |
|---|---|
| SMILES | COCC1=CC(=NC(=N1)C2=CC=CC=C2)N3CCSCC3 |
Product Overview
4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine (CAS 339279-01-5), with molecular formula C16H19N3OS and molecular weight 301.12 g/mol. IUPAC: 4-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]thiomorpholine.
Chemical Property Profile of 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine
Property Insights of 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine
The XLogP value of 2.8432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine. With a topological polar surface area (TPSA) of 38.25 Ų, 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine has 0 hydrogen bond donor(s) and 5 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-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine?
The CAS number of 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine is 339279-01-5.
What is the molecular formula of 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine?
The molecular formula of 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine is C16H19N3OS.
What is the molecular weight of 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine?
The molecular weight of 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine is 301.12 g/mol.
Where can I buy 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine?
You can request a quote for 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-[6-(Methoxymethyl)-2-phenyl-4-pyrimidinyl]thiomorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.