![13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine structure](/static/products/6057/60579-42-2.webp)
13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine
TL;DR: 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine (CAS 60579-42-2) is a chemical compound with molecular formula C21H17ClN2 and molecular weight 332.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(4-chlorophenyl)-1,10-diazatetracyclo[8.6.1.03,8.011,16]heptadeca-3,5,7,11,13,15-hexaene
Also Known As: 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine, 17-(4-Chlorophenyl)-1,10-diazatetracyclo[8.6.1.03,8.011,16]heptadeca-3,5,7,11,13,15-hexaene
| Molecular Formula | C21H17ClN2 |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.10803 |
| Heavy Atoms | 24 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 60579-42-2 |
|---|---|
| SMILES | C1C2=CC=CC=C2CN3C(N1C4=CC=CC=C43)C5=CC=C(C=C5)Cl |
| InChIKey | DPYPESDLIJRPDN-UHFFFAOYSA-N |
Product Overview
13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine (CAS 60579-42-2), with molecular formula C21H17ClN2 and molecular weight 332.11 g/mol. IUPAC: 17-(4-chlorophenyl)-1,10-diazatetracyclo[8.6.1.03,8.011,16]heptadeca-3,5,7,11,13,15-hexaene.
Chemical Property Profile of 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine
Property Insights of 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine
The XLogP value of 5.3 indicates that 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine?
The CAS number of 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine is 60579-42-2.
What is the molecular formula of 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine?
The molecular formula of 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine is C21H17ClN2.
What is the molecular weight of 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine?
The molecular weight of 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine is 332.11 g/mol.
Where can I buy 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine?
You can request a quote for 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine?
Yes, KEHONG BIO provides custom synthesis services for 13-(4-Chlorophenyl)-6,11-dihydro-5,12-methanodibenzo[b,f][1,4]diazocine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.