8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride
TL;DR: 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride (CAS 69739-51-1) is a chemical compound with molecular formula C10H12Cl3N and molecular weight 251.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,9-dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine;hydrochloride
Also Known As: LY 134046, 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride
| Molecular Formula | C10H12Cl3N |
|---|---|
| Molecular Weight | 251.00 g/mol |
| LogP | 3.451 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.00352 |
| Heavy Atoms | 14 |
| Complexity | 325.3883 |
Chemical Identifiers
| CAS Number | 69739-51-1 |
|---|---|
| SMILES | C1CC2=C(CNC1)C(=C(C=C2)Cl)Cl.Cl |
Product Overview
8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride (CAS 69739-51-1), with molecular formula C10H12Cl3N and molecular weight 251.00 g/mol. IUPAC: 8,9-dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine;hydrochloride.
Chemical Property Profile of 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride
Property Insights of 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride
The XLogP value of 3.451 indicates that 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride 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 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride?
The CAS number of 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride is 69739-51-1.
What is the molecular formula of 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride?
The molecular formula of 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride is C10H12Cl3N.
What is the molecular weight of 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride?
The molecular weight of 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride is 251.00 g/mol.
Where can I buy 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride?
You can request a quote for 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 8,9-Dichloro-2,3,4,5-tetrahydro-1H-2-benzazepine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.