3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine
TL;DR: 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine (CAS 10538-33-7) is a chemical compound with molecular formula C28H41NS and molecular weight 423.29596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,7-bis(2,4,4-trimethylpentan-2-yl)-10H-phenothiazine
Also Known As: 3,7-Bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine, 3,7-di-tert-octylphenothiazine, 3,7-bis(2,4,4-trimethylpentan-2-yl)-10H-phenothiazine, 3,7-Di-tert-octyl-10H-phenothiazine, 10h-phenothiazine, 3,7-bis(1,1,3,3-tetramethylbutyl)-
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C28H41NS |
| Molecular Weight | 423.29596 g/mol |
| XLogP | 10.4 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.29596 Da |
| Heavy Atoms | 30 |
| Complexity | 528.0 |
| SMILES | CC(C)(C)CC(C)(C)C1=CC2=C(C=C1)NC3=C(S2)C=C(C=C3)C(C)(C)CC(C)(C)C |
| InChIKey | VZXJHQBFMJESBV-UHFFFAOYSA-N |
Chemical Property Profile of 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine
Property Insights of 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine
The XLogP value of 10.4 indicates that 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine?
The CAS number of 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine is 10538-33-7.
What is the molecular formula of 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine?
The molecular formula of 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine is C28H41NS.
What is the molecular weight of 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine?
The molecular weight of 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine is 423.29596 g/mol.
Where can I buy 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine?
You can request a quote for 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine?
Yes, CoreyChem provides custom synthesis services for 3,7-bis(1,1,3,3-tetramethylbutyl)-10H-phenothiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.