10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one
TL;DR: 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one (CAS 374546-75-5) is a chemical compound with molecular formula C16H13NO3S and molecular weight 299.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
Also Known As: 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one, 10-(2-Methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
| Molecular Formula | C16H13NO3S |
|---|---|
| Molecular Weight | 299.06 g/mol |
| LogP | 3.4138 |
| Topological Polar Surface Area | 52.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.0616 |
| Heavy Atoms | 21 |
| Complexity | 894.16376 |
Chemical Identifiers
| CAS Number | 374546-75-5 |
|---|---|
| SMILES | COC1=CC=CC=C1C2=NC3=C(C4=C(S3)CCC4)C(=O)O2 |
Product Overview
10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one (CAS 374546-75-5), with molecular formula C16H13NO3S and molecular weight 299.06 g/mol. IUPAC: 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one.
Chemical Property Profile of 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one
Property Insights of 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one
The XLogP value of 3.4138 indicates that 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.33 Ų, 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one 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 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one?
The CAS number of 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one is 374546-75-5.
What is the molecular formula of 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one?
The molecular formula of 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one is C16H13NO3S.
What is the molecular weight of 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one?
The molecular weight of 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one is 299.06 g/mol.
Where can I buy 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one?
You can request a quote for 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one?
Yes, KEHONG BIO provides custom synthesis services for 10-(2-methoxyphenyl)-11-oxa-7-thia-9-azatricyclo[6.4.0.0,2,6]dodeca-1(8),2(6),9-trien-12-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.