地佐辛
TL;DR: 地佐辛 (CAS 53648-55-8) is a chemical compound with molecular formula C16H23NO and molecular weight 245.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
地佐辛
(1R,9S)-15-amino-1-methyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol
Also Known As: Dalgan, DEZOCINE, Dezocina, Dezocinum, Dezocinum [INN-Latin]
| Molecular Formula | C16H23NO |
|---|---|
| Molecular Weight | 245.18 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 245.17796 |
| Heavy Atoms | 18 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 53648-55-8 |
|---|---|
| SMILES | C[C@]12CCCCC[C@H](C1N)CC3=C2C=C(C=C3)O |
| InChIKey | VTMVHDZWSFQSQP-ZDKIRESNSA-N |
Product Overview
地佐辛 (CAS 53648-55-8), with molecular formula C16H23NO and molecular weight 245.18 g/mol. IUPAC: (1R,9S)-15-amino-1-methyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol.
Chemical Property Profile of 地佐辛
Property Insights of 地佐辛
The XLogP value of 3.7 indicates that 地佐辛 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.3 Ų, 地佐辛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 地佐辛 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 地佐辛?
The CAS number of 地佐辛 is 53648-55-8.
What is the molecular formula of 地佐辛?
The molecular formula of 地佐辛 is C16H23NO.
What is the molecular weight of 地佐辛?
The molecular weight of 地佐辛 is 245.18 g/mol.
Where can I buy 地佐辛?
You can request a quote for 地佐辛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 地佐辛?
Yes, KEHONG BIO provides custom synthesis services for 地佐辛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.