2,3,4,5-tetrahydro-1H-1-benzazepine
TL;DR: 2,3,4,5-tetrahydro-1H-1-benzazepine (CAS 17090-70-9) is a chemical compound with molecular formula C10H13N and molecular weight 147.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetrahydro-1H-1-benzazepine
Also Known As: 2,3,4,5-Tetrahydro-1H-benzo[b]azepine, 2,3,4,5-Tetrahydro-1H-1-benzazepine, tetrahydrobenzazepine, 1H-1-Benzazepine, 2,3,4,5-tetrahydro-, BENZOAZEPANE
| Molecular Formula | C10H13N |
|---|---|
| Molecular Weight | 147.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.1048 |
| Heavy Atoms | 11 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 17090-70-9 |
|---|---|
| SMILES | C1CCNC2=CC=CC=C2C1 |
| InChIKey | MZBVNYACSSGXID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4,5-tetrahydro-1H-1-benzazepine (CAS 17090-70-9), with molecular formula C10H13N and molecular weight 147.10 g/mol. IUPAC: 2,3,4,5-tetrahydro-1H-1-benzazepine.
Chemical Property Profile of 2,3,4,5-tetrahydro-1H-1-benzazepine
Property Insights of 2,3,4,5-tetrahydro-1H-1-benzazepine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4,5-tetrahydro-1H-1-benzazepine. With a topological polar surface area (TPSA) of 12.0 Ų, 2,3,4,5-tetrahydro-1H-1-benzazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5-tetrahydro-1H-1-benzazepine 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 2,3,4,5-tetrahydro-1H-1-benzazepine?
The CAS number of 2,3,4,5-tetrahydro-1H-1-benzazepine is 17090-70-9.
What is the molecular formula of 2,3,4,5-tetrahydro-1H-1-benzazepine?
The molecular formula of 2,3,4,5-tetrahydro-1H-1-benzazepine is C10H13N.
What is the molecular weight of 2,3,4,5-tetrahydro-1H-1-benzazepine?
The molecular weight of 2,3,4,5-tetrahydro-1H-1-benzazepine is 147.10 g/mol.
Where can I buy 2,3,4,5-tetrahydro-1H-1-benzazepine?
You can request a quote for 2,3,4,5-tetrahydro-1H-1-benzazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5-tetrahydro-1H-1-benzazepine?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5-tetrahydro-1H-1-benzazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.