Chloramitriptyline hydrochloride
TL;DR: Chloramitriptyline hydrochloride (CAS 3589-31-9) is a chemical compound with molecular formula C20H25Cl2N and molecular weight 349.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)propyl-dimethylazanium chloride
Also Known As: L 572451 hydrochloride, Chloramitriptyline hydrochloride, 3-Chloro-N,N-dimethyl-10,11-dihydro-5H-dibenzo(a,d)cycloheptene-5-propylamine hydrochloride, 5H-Dibenzo(a,d)cycloheptene-5-propylamine, 3-chloro-10,11-dihydro-N,N-dimethyl-, HCl, 5H-Dibenzo(a,d)cycloheptene-5-propylamine, 10,11-dihydro-3-chloro-N,N-dimethyl-, monohydrochloride
| Molecular Formula | C20H25Cl2N |
|---|---|
| Molecular Weight | 349.14 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.1364 |
| Heavy Atoms | 23 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 3589-31-9 |
|---|---|
| SMILES | C[NH+](C)CCCC1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.[Cl-] |
| InChIKey | CLZDRXDNLNORQJ-UHFFFAOYSA-N |
Product Overview
Chloramitriptyline hydrochloride (CAS 3589-31-9), with molecular formula C20H25Cl2N and molecular weight 349.14 g/mol. IUPAC: 3-(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)propyl-dimethylazanium chloride.
Chemical Property Profile of Chloramitriptyline hydrochloride
Property Insights of Chloramitriptyline hydrochloride
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloramitriptyline hydrochloride. With a topological polar surface area (TPSA) of 4.4 Ų, Chloramitriptyline hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chloramitriptyline hydrochloride 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 Chloramitriptyline hydrochloride?
The CAS number of Chloramitriptyline hydrochloride is 3589-31-9.
What is the molecular formula of Chloramitriptyline hydrochloride?
The molecular formula of Chloramitriptyline hydrochloride is C20H25Cl2N.
What is the molecular weight of Chloramitriptyline hydrochloride?
The molecular weight of Chloramitriptyline hydrochloride is 349.14 g/mol.
Where can I buy Chloramitriptyline hydrochloride?
You can request a quote for Chloramitriptyline hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloramitriptyline hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Chloramitriptyline hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.