1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇
TL;DR: 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 (CAS 16808-63-2) is a chemical compound with molecular formula C14H19NO and molecular weight 217.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇
1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
Also Known As: Norcyclazocine, Normetazocine, Norpentazocine, dl-Normetazocine, cis-N-normetazocine
| Molecular Formula | C14H19NO |
|---|---|
| Molecular Weight | 217.15 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 217.14667 |
| Heavy Atoms | 16 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 16808-63-2 |
|---|---|
| SMILES | CC1C2CC3=C(C1(CCN2)C)C=C(C=C3)O |
| InChIKey | DXESFJJJWBHLJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 (CAS 16808-63-2), with molecular formula C14H19NO and molecular weight 217.15 g/mol. IUPAC: 1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol.
Chemical Property Profile of 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇
Property Insights of 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇. With a topological polar surface area (TPSA) of 32.3 Ų, 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 has 2 hydrogen bond donor(s) and 2 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 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇?
The CAS number of 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 is 16808-63-2.
What is the molecular formula of 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇?
The molecular formula of 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 is C14H19NO.
What is the molecular weight of 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇?
The molecular weight of 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 is 217.15 g/mol.
Where can I buy 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇?
You can request a quote for 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4,5,6-六氢-6,11-二甲基-2,6-亚甲基-3-苯并吖辛因-8-醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.