![3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine structure](/static/products/1308/13080-74-5.webp)
3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine
TL;DR: 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine (CAS 13080-74-5) is a chemical compound with molecular formula C14H11Cl2N and molecular weight 263.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,9-dichloro-6,11-dihydro-5H-benzo[b][1]benzazepine
Also Known As: 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine, Carbamazepine Impurity 5, Clomipramine Impurity 8, 2,9-dichloro-6,11-dihydro-5H-benzo[b][1]benzazepine, s11371
| Molecular Formula | C14H11Cl2N |
|---|---|
| Molecular Weight | 263.03 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 263.02686 |
| Heavy Atoms | 17 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 13080-74-5 |
|---|---|
| SMILES | C1CC2=C(C=C(C=C2)Cl)NC3=C1C=CC(=C3)Cl |
| InChIKey | RRRKOLZRCMHJSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine (CAS 13080-74-5), with molecular formula C14H11Cl2N and molecular weight 263.03 g/mol. IUPAC: 2,9-dichloro-6,11-dihydro-5H-benzo[b][1]benzazepine.
Chemical Property Profile of 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine
Property Insights of 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine
The XLogP value of 5.0 indicates that 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine 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 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine?
The CAS number of 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine is 13080-74-5.
What is the molecular formula of 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine?
The molecular formula of 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine is C14H11Cl2N.
What is the molecular weight of 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine?
The molecular weight of 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine is 263.03 g/mol.
Where can I buy 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine?
You can request a quote for 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Dichloro-10,11-dihydro-5H-dibenzo[b,f]azepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.