RefChem:1077399
TL;DR: RefChem:1077399 (CAS 15918-70-4) is a chemical compound with molecular formula C14H19ClN2O and molecular weight 266.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-methoxy-6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride
Also Known As: 1,2,3,4,5,6-Hexahydro-9-methoxy-6-methyl-azepino(4,5-b)indole hydrochloride, Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-6-methyl-, monohydrochloride, 9-Methoxy-6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-iumchloride, 9-methoxy-6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride, AZEPINO(4,5-b)INDOLE, 1,2,3,4,5,6-HEXAHYDRO-9-METHOXY-6-METHYL-, MONOHYDROCHLORI
| Molecular Formula | C14H19ClN2O |
|---|---|
| Molecular Weight | 266.12 g/mol |
| LogP | -2.05 |
| Topological Polar Surface Area | 25.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.1186 |
| Heavy Atoms | 18 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 15918-70-4 |
|---|---|
| SMILES | C[NH+]1C2=C(CCNCC2)C3=C1C=CC(=C3)OC.[Cl-] |
| InChIKey | GZEPJCLDITYJFJ-UHFFFAOYSA-N |
Product Overview
RefChem:1077399 (CAS 15918-70-4), with molecular formula C14H19ClN2O and molecular weight 266.12 g/mol. IUPAC: 9-methoxy-6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-6-ium chloride.
Chemical Property Profile of RefChem:1077399
Property Insights of RefChem:1077399
The XLogP value of -2.05 indicates that RefChem:1077399 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 25.7 Ų, RefChem:1077399 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1077399 has 2 hydrogen bond donor(s) and 3 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 RefChem:1077399?
The CAS number of RefChem:1077399 is 15918-70-4.
What is the molecular formula of RefChem:1077399?
The molecular formula of RefChem:1077399 is C14H19ClN2O.
What is the molecular weight of RefChem:1077399?
The molecular weight of RefChem:1077399 is 266.12 g/mol.
Where can I buy RefChem:1077399?
You can request a quote for RefChem:1077399 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1077399?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1077399 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.