Norcyclobenzaprine
TL;DR: Norcyclobenzaprine (CAS 303-50-4) is a chemical compound with molecular formula C19H19N and molecular weight 261.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)propan-1-amine
Also Known As: Norcyclobenzaprine, Norproheptatrien, Desmethylcyclobenzaprine, Dehydronortriptyline, 10,11-Dehydronortriptyline
| Molecular Formula | C19H19N |
|---|---|
| Molecular Weight | 261.15 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.15176 |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 303-50-4 |
|---|---|
| SMILES | CNCCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31 |
| InChIKey | XECQQDXTQRYYBH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Norcyclobenzaprine (CAS 303-50-4), with molecular formula C19H19N and molecular weight 261.15 g/mol. IUPAC: N-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)propan-1-amine.
Chemical Property Profile of Norcyclobenzaprine
Property Insights of Norcyclobenzaprine
The XLogP value of 4.7 indicates that Norcyclobenzaprine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Norcyclobenzaprine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Norcyclobenzaprine 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 Norcyclobenzaprine?
The CAS number of Norcyclobenzaprine is 303-50-4.
What is the molecular formula of Norcyclobenzaprine?
The molecular formula of Norcyclobenzaprine is C19H19N.
What is the molecular weight of Norcyclobenzaprine?
The molecular weight of Norcyclobenzaprine is 261.15 g/mol.
Where can I buy Norcyclobenzaprine?
You can request a quote for Norcyclobenzaprine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Norcyclobenzaprine?
Yes, KEHONG BIO provides custom synthesis services for Norcyclobenzaprine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.