去甲多塞平
TL;DR: 去甲多塞平 (CAS 1225-56-5) is a chemical compound with molecular formula C18H19NO and molecular weight 265.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
去甲多塞平
3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N-methylpropan-1-amine
Also Known As: Desmethyldoxepin, Demethyldoxepin, Nordoxepin, desmethyldoxepine, Desmethyl doxepin
| Molecular Formula | C18H19NO |
|---|---|
| Molecular Weight | 265.15 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.14667 |
| Heavy Atoms | 20 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 1225-56-5 |
|---|---|
| SMILES | CNCCC=C1C2=CC=CC=C2COC3=CC=CC=C31 |
| InChIKey | HVKCEFHNSNZIHO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
去甲多塞平 (CAS 1225-56-5), with molecular formula C18H19NO and molecular weight 265.15 g/mol. IUPAC: 3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N-methylpropan-1-amine.
Chemical Property Profile of 去甲多塞平
Property Insights of 去甲多塞平
The XLogP value of 3.8 indicates that 去甲多塞平 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, 去甲多塞平 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 去甲多塞平 has 1 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 去甲多塞平?
The CAS number of 去甲多塞平 is 1225-56-5.
What is the molecular formula of 去甲多塞平?
The molecular formula of 去甲多塞平 is C18H19NO.
What is the molecular weight of 去甲多塞平?
The molecular weight of 去甲多塞平 is 265.15 g/mol.
Where can I buy 去甲多塞平?
You can request a quote for 去甲多塞平 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 去甲多塞平?
Yes, KEHONG BIO provides custom synthesis services for 去甲多塞平 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.