Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride
TL;DR: Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride (CAS 42840-06-2) is a chemical compound with molecular formula C19H22ClNO3 and molecular weight 347.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylaminomethyl)-4-methoxyxanthen-9-one;hydrochloride
Also Known As: 4-bromo methanesulphonanilide, 3-(Diethylamino)methyl-4-methoxy-9-xanthone hydrochloride, Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride, 4-(Diethylamino)methyl-4-methoxyxanthen-9-one hydrochloride, 3-(diethylaminomethyl)-4-methoxyxanthen-9-one,hydrochloride
| Molecular Formula | C19H22ClNO3 |
|---|---|
| Molecular Weight | 347.13 g/mol |
| LogP | 4.2184 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.1288 |
| Heavy Atoms | 24 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 42840-06-2 |
|---|---|
| SMILES | CCN(CC)CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3O2)OC.Cl |
| InChIKey | FQCMNSRHNHUIHH-UHFFFAOYSA-N |
Product Overview
Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride (CAS 42840-06-2), with molecular formula C19H22ClNO3 and molecular weight 347.13 g/mol. IUPAC: 3-(diethylaminomethyl)-4-methoxyxanthen-9-one;hydrochloride.
Chemical Property Profile of Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride
Property Insights of Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride
The XLogP value of 4.2184 indicates that Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride has 1 hydrogen bond donor(s) and 4 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 Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride?
The CAS number of Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride is 42840-06-2.
What is the molecular formula of Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride?
The molecular formula of Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride is C19H22ClNO3.
What is the molecular weight of Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride?
The molecular weight of Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride is 347.13 g/mol.
Where can I buy Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride?
You can request a quote for Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Xanthen-9-one, 3-(diethylamino)methyl-4-methoxy-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.