Didemethylclomipramine
TL;DR: Didemethylclomipramine (CAS 62724-32-7) is a chemical compound with molecular formula C17H19ClN2 and molecular weight 286.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propan-1-amine
Also Known As: Didemethylclomipramine, Didesmethylclomipramine, N,N-Didemethylchlorimipramine, N-Didemthyl-chlorimipramine, Bisdesmethylchlorimipramine
| Molecular Formula | C17H19ClN2 |
|---|---|
| Molecular Weight | 286.12 g/mol |
| LogP | 3.9255 |
| Topological Polar Surface Area | 29.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.1237 |
| Heavy Atoms | 20 |
| Complexity | 609.689 |
Chemical Identifiers
| CAS Number | 62724-32-7 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C3=C1C=CC(=C3)Cl)CCCN |
Product Overview
Didemethylclomipramine (CAS 62724-32-7), with molecular formula C17H19ClN2 and molecular weight 286.12 g/mol. IUPAC: 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propan-1-amine.
Chemical Property Profile of Didemethylclomipramine
Property Insights of Didemethylclomipramine
The XLogP value of 3.9255 indicates that Didemethylclomipramine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.26 Ų, Didemethylclomipramine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Didemethylclomipramine 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 Didemethylclomipramine?
The CAS number of Didemethylclomipramine is 62724-32-7.
What is the molecular formula of Didemethylclomipramine?
The molecular formula of Didemethylclomipramine is C17H19ClN2.
What is the molecular weight of Didemethylclomipramine?
The molecular weight of Didemethylclomipramine is 286.12 g/mol.
Where can I buy Didemethylclomipramine?
You can request a quote for Didemethylclomipramine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Didemethylclomipramine?
Yes, KEHONG BIO provides custom synthesis services for Didemethylclomipramine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.