1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride
TL;DR: 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride (CAS 54955-08-7) is a chemical compound with molecular formula C15H19ClN2 and molecular weight 262.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-diazatetracyclo[8.6.1.05,17.011,16]heptadeca-10(17),11,13,15-tetraene;hydrochloride
Also Known As: 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride, Piperazino(1,2-a)indole, 1,10-tetramethylene-, hydrochloride, 3,11b-Diazacyclohepta(jk)fluorene, 1,2,3,3a,4,5,6,7-octahydro-, monohydrochloride, 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta[jk]fluorene--hydrogen chloride (1/1), RefChem:269763
| Molecular Formula | C15H19ClN2 |
|---|---|
| Molecular Weight | 262.12 g/mol |
| LogP | 3.4338 |
| Topological Polar Surface Area | 16.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.1237 |
| Heavy Atoms | 18 |
| Complexity | 573.12244 |
Chemical Identifiers
| CAS Number | 54955-08-7 |
|---|---|
| SMILES | C1CCC2=C3C(C1)NCCN3C4=CC=CC=C24.Cl |
Product Overview
1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride (CAS 54955-08-7), with molecular formula C15H19ClN2 and molecular weight 262.12 g/mol. IUPAC: 1,4-diazatetracyclo[8.6.1.05,17.011,16]heptadeca-10(17),11,13,15-tetraene;hydrochloride.
Chemical Property Profile of 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride
Property Insights of 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride
The XLogP value of 3.4338 indicates that 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.96 Ų, 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride has 1 hydrogen bond donor(s) and 1 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 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride?
The CAS number of 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride is 54955-08-7.
What is the molecular formula of 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride?
The molecular formula of 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride is C15H19ClN2.
What is the molecular weight of 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride?
The molecular weight of 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride is 262.12 g/mol.
Where can I buy 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride?
You can request a quote for 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,3a,4,5,6,7-Octahydro-3,11b-diazacyclohepta(jk)fluorene monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.