5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride
TL;DR: 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride (CAS 18059-99-9) is a chemical compound with molecular formula C18H19ClN2O and molecular weight 314.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylideneamino)oxyethyl]azanium chloride
Also Known As: Deparon, Demexiptiline hydrochloride, 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride, 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime monohydrochloride, 5H-Dibenzo(a,d)cyclohepten-5-one, O-(2-(methylamino)ethyl)oxime, monohydrochloride
| Molecular Formula | C18H19ClN2O |
|---|---|
| Molecular Weight | 314.12 g/mol |
| LogP | -0.98 |
| Topological Polar Surface Area | 38.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.1186 |
| Heavy Atoms | 22 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 18059-99-9 |
|---|---|
| SMILES | C[NH2+]CCON=C1C2=CC=CC=C2C=CC3=CC=CC=C31.[Cl-] |
| InChIKey | MZTHMUGFMPRTIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride (CAS 18059-99-9), with molecular formula C18H19ClN2O and molecular weight 314.12 g/mol. IUPAC: methyl-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylideneamino)oxyethyl]azanium chloride.
Chemical Property Profile of 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride
Property Insights of 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride
The XLogP value of -0.98 indicates that 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.2 Ų, 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride has 1 hydrogen bond donor(s) and 3 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 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride?
The CAS number of 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride is 18059-99-9.
What is the molecular formula of 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride?
The molecular formula of 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride is C18H19ClN2O.
What is the molecular weight of 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride?
The molecular weight of 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride is 314.12 g/mol.
Where can I buy 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride?
You can request a quote for 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5H-Dibenzo(a,d)cyclohepten-5-one O-(2-(methylamino)ethyl)oxime hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.