3-Hydroxyamitriptyline
TL;DR: 3-Hydroxyamitriptyline (CAS 30235-44-0) is a chemical compound with molecular formula C20H23NO and molecular weight 293.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(dimethylamino)propylidene]tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-5-ol
Also Known As: 3-Hydroxyamitriptyline, 5-(3-(Dimethylamino)propylidene)-10,11-dihydro-5H-dibenzo(a,d)cyclohepten-3-ol, 5H-Dibenzo(a,d)cyclohepten-3-ol, 5-(3-(dimethylamino)propylidene)-10,11-dihydro-
| Molecular Formula | C20H23NO |
|---|---|
| Molecular Weight | 293.18 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.17798 |
| Heavy Atoms | 22 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 30235-44-0 |
|---|---|
| SMILES | CN(C)CCC=C1C2=CC=CC=C2CCC3=C1C=C(C=C3)O |
| InChIKey | GSCNHQHCSDAANR-UHFFFAOYSA-N |
Product Overview
3-Hydroxyamitriptyline (CAS 30235-44-0), with molecular formula C20H23NO and molecular weight 293.18 g/mol. IUPAC: 2-[3-(dimethylamino)propylidene]tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-5-ol.
Chemical Property Profile of 3-Hydroxyamitriptyline
Property Insights of 3-Hydroxyamitriptyline
The XLogP value of 4.7 indicates that 3-Hydroxyamitriptyline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 3-Hydroxyamitriptyline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxyamitriptyline 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 3-Hydroxyamitriptyline?
The CAS number of 3-Hydroxyamitriptyline is 30235-44-0.
What is the molecular formula of 3-Hydroxyamitriptyline?
The molecular formula of 3-Hydroxyamitriptyline is C20H23NO.
What is the molecular weight of 3-Hydroxyamitriptyline?
The molecular weight of 3-Hydroxyamitriptyline is 293.18 g/mol.
Where can I buy 3-Hydroxyamitriptyline?
You can request a quote for 3-Hydroxyamitriptyline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxyamitriptyline?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxyamitriptyline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.