![6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine structure](/static/products/3148/31486-25-6.webp)
6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine
TL;DR: 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine (CAS 31486-25-6) is a chemical compound with molecular formula C16H17N and molecular weight 223.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine
Also Known As: 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine, 6,7,12,13-tetrahydro-5H-dibenzo[c,g]azonine, 6,11,12,13-Tetrahydro-5H-12-aza-dibenzo[a,e]cyclononene
| Molecular Formula | C16H17N |
|---|---|
| Molecular Weight | 223.14 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 223.1361 |
| Heavy Atoms | 17 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 31486-25-6 |
|---|---|
| SMILES | C1CC2=CC=CC=C2CNCC3=CC=CC=C31 |
| InChIKey | JGPFCDDHLVEAEE-UHFFFAOYSA-N |
Product Overview
6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine (CAS 31486-25-6), with molecular formula C16H17N and molecular weight 223.14 g/mol. IUPAC: 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine.
Chemical Property Profile of 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine
Property Insights of 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine
The XLogP value of 3.1 indicates that 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine 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 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine?
The CAS number of 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine is 31486-25-6.
What is the molecular formula of 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine?
The molecular formula of 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine is C16H17N.
What is the molecular weight of 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine?
The molecular weight of 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine is 223.14 g/mol.
Where can I buy 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine?
You can request a quote for 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine?
Yes, KEHONG BIO provides custom synthesis services for 6,7,12,13-tetrahydro-5H-benzo[d][2]benzazonine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.