Iprotiazem
TL;DR: Iprotiazem (CAS 105118-13-6) is a chemical compound with molecular formula C37H49N3O5S and molecular weight 647.3393 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-4-methyl-2-propan-2-yl-2-[2-[4-[4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-1-yl]butoxy]phenyl]-1,4-benzothiazin-3-one
Also Known As: Iprotiazem, Iprotiazem [INN], iprotiazemum, (2R)-4-methyl-2-propan-2-yl-2-[2-[4-[4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-1-yl]butoxy]phenyl]-1,4-benzothiazin-3-one, (+)-(R)-2-Isopropyl-4-methyl-2-(o-(4-(4-(3,4,5-trimethoxyphenethyl)-1-piperazinyl)butoxy)phenyl)-2H-1,4-benzothiazin-3(4H)-one
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C37H49N3O5S |
| Molecular Weight | 647.3393 g/mol |
| XLogP | 6.9 |
| Topological Polar Surface Area (TPSA) | 89.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 647.3393 Da |
| Heavy Atoms | 46 |
| Complexity | 921.0 |
| SMILES | CC(C)[C@]1(C(=O)N(C2=CC=CC=C2S1)C)C3=CC=CC=C3OCCCCN4CCN(CC4)CCC5=CC(=C(C(=C5)OC)OC)OC |
| InChIKey | JSLZUBLGGPEVQN-DIPNUNPCSA-N |
Chemical Property Profile of Iprotiazem
Property Insights of Iprotiazem
The XLogP value of 6.9 indicates that Iprotiazem is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Iprotiazem. Following Lipinski's Rule of Five, Iprotiazem has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Iprotiazem?
The CAS number of Iprotiazem is 105118-13-6.
What is the molecular formula of Iprotiazem?
The molecular formula of Iprotiazem is C37H49N3O5S.
What is the molecular weight of Iprotiazem?
The molecular weight of Iprotiazem is 647.3393 g/mol.
Where can I buy Iprotiazem?
You can request a quote for Iprotiazem directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Iprotiazem?
Yes, CoreyChem provides custom synthesis services for Iprotiazem and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.