![3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione structure](/static/products/3301/330180-47-7.webp)
3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione
TL;DR: 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione (CAS 330180-47-7) is a chemical compound with molecular formula C15H20N2OS and molecular weight 276.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione
Also Known As: 3-[[cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione, 3-[(cyclohexyl-methyl-amino)methyl]benzooxazole-2-thione, 3-((cyclohexyl(methyl)amino)methyl)benzo[d]oxazole-2(3H)-thione, 3-{[cyclohexyl(methyl)amino]methyl}-1,3-benzoxazole-2(3H)-thione, 3-{[CYCLOHEXYL(METHYL)AMINO]METHYL}-2,3-DIHYDRO-1,3-BENZOXAZOLE-2-THIONE
| Molecular Formula | C15H20N2OS |
|---|---|
| Molecular Weight | 276.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 47.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.12964 |
| Heavy Atoms | 19 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 330180-47-7 |
|---|---|
| SMILES | CN(CN1C2=CC=CC=C2OC1=S)C3CCCCC3 |
| InChIKey | JHAGQQJEHFPRJG-UHFFFAOYSA-N |
Product Overview
3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione (CAS 330180-47-7), with molecular formula C15H20N2OS and molecular weight 276.13 g/mol. IUPAC: 3-[[cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione.
Chemical Property Profile of 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione
Property Insights of 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione
The XLogP value of 3.9 indicates that 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.8 Ų, 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione 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 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione?
The CAS number of 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione is 330180-47-7.
What is the molecular formula of 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione?
The molecular formula of 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione is C15H20N2OS.
What is the molecular weight of 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione?
The molecular weight of 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione is 276.13 g/mol.
Where can I buy 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione?
You can request a quote for 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-[[Cyclohexyl(methyl)amino]methyl]-1,3-benzoxazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.