RefChem:1073430
TL;DR: RefChem:1073430 (CAS 40494-50-6) is a chemical compound with molecular formula C19H27ClN2O and molecular weight 334.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-6,7,8,9-tetrahydrobenzo[7]annulen-5-imine;hydrochloride
Also Known As: C19H26N2O.ClH.1/2H2O, C19-H26-N2-O.Cl-H.1/2H2-O, 6,7,8,9-Tetrahydro-5H-benzocyclohepten-5-one O-(3-alpha-tropanyl)oxime hydrochloride hydrate, 5H-Benzocyclohepten-5-one, 6,7,8,9-tetrahydro-, O-(8-methyl-8-azabicyclo(3.2.1)oct-3-yl)oxime,hydrochloride, hydrate (2:2:1), endo-, RefChem:1073430
| Molecular Formula | C19H27ClN2O |
|---|---|
| Molecular Weight | 334.18 g/mol |
| LogP | 4.1807 |
| Topological Polar Surface Area | 24.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 334.18118 |
| Heavy Atoms | 23 |
| Complexity | 560.243 |
Chemical Identifiers
| CAS Number | 40494-50-6 |
|---|---|
| SMILES | CN1C2CCC1CC(C2)O/N=C/3\CCCCC4=CC=CC=C43.Cl |
Product Overview
RefChem:1073430 (CAS 40494-50-6), with molecular formula C19H27ClN2O and molecular weight 334.18 g/mol. IUPAC: (E)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)oxy]-6,7,8,9-tetrahydrobenzo[7]annulen-5-imine;hydrochloride.
Chemical Property Profile of RefChem:1073430
Property Insights of RefChem:1073430
The XLogP value of 4.1807 indicates that RefChem:1073430 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.83 Ų, RefChem:1073430 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1073430 has 0 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 RefChem:1073430?
The CAS number of RefChem:1073430 is 40494-50-6.
What is the molecular formula of RefChem:1073430?
The molecular formula of RefChem:1073430 is C19H27ClN2O.
What is the molecular weight of RefChem:1073430?
The molecular weight of RefChem:1073430 is 334.18 g/mol.
Where can I buy RefChem:1073430?
You can request a quote for RefChem:1073430 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1073430?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1073430 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.