2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine
TL;DR: 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine (CAS 73698-54-1) is a chemical compound with molecular formula C12H16N2O2 and molecular weight 220.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,8-dimethyl-2,4,7,9-tetrahydro-[1,3]oxazino[6,5-g][1,3]benzoxazine
Also Known As: NCIOpen2_004802, 4-27-00-08441 (Beilstein Handbook Reference), Benzo(1,2-e:4,5-e')bis(1,3)oxazine, 2,3,4,7,8,9-hexahydro-3,8-dimethyl-, J1.372.081I, 2,3,4,7,8,9-Hexahydro-3,8-dimethylbenzo(1,2-e:4,5-e')bis(1,3)oxazine
| Molecular Formula | C12H16N2O2 |
|---|---|
| Molecular Weight | 220.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 24.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 220.12119 |
| Heavy Atoms | 16 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 73698-54-1 |
|---|---|
| SMILES | CN1CC2=CC3=C(CN(CO3)C)C=C2OC1 |
| InChIKey | FNLAFZPBHVDDMP-UHFFFAOYSA-N |
Product Overview
2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine (CAS 73698-54-1), with molecular formula C12H16N2O2 and molecular weight 220.12 g/mol. IUPAC: 3,8-dimethyl-2,4,7,9-tetrahydro-[1,3]oxazino[6,5-g][1,3]benzoxazine.
Chemical Property Profile of 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine
Property Insights of 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine. With a topological polar surface area (TPSA) of 24.9 Ų, 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine has 0 hydrogen bond donor(s) and 4 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 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine?
The CAS number of 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine is 73698-54-1.
What is the molecular formula of 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine?
The molecular formula of 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine is C12H16N2O2.
What is the molecular weight of 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine?
The molecular weight of 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine is 220.12 g/mol.
Where can I buy 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine?
You can request a quote for 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,7,8,9-Hexahydro-3,8-dimethyl-benzo(1,2-E:4,5-e')bis(1,3)oxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.