6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride
TL;DR: 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride (CAS 15923-42-9) is a chemical compound with molecular formula C13H17ClN2 and molecular weight 236.10803 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride
Also Known As: PNU 22394 hydrochloride, PNU-22394 hydrochloride, U-22394A, 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride, 6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium;chloride
Technical Specifications
| Molecular Formula | C13H17ClN2 |
| Molecular Weight | 236.10803 g/mol |
| XLogP | -2.06 |
| Topological Polar Surface Area (TPSA) | 16.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 236.10803 Da |
| Heavy Atoms | 16 |
| Complexity | 282.0 |
| SMILES | C[NH+]1C2=C(CCNCC2)C3=CC=CC=C31.[Cl-] |
| InChIKey | SAIGGEUWSYESTR-UHFFFAOYSA-N |
Chemical Property Profile of 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride
Property Insights of 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride
The XLogP value of -2.06 indicates that 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 16.5 Ų, 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride?
The CAS number of 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride is 15923-42-9.
What is the molecular formula of 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride?
The molecular formula of 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride is C13H17ClN2.
What is the molecular weight of 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride?
The molecular weight of 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride is 236.10803 g/mol.
Where can I buy 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride?
You can request a quote for 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride?
Yes, CoreyChem provides custom synthesis services for 6-Methyl-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.