氯鲁坎酮N-氧化物
TL;DR: 氯鲁坎酮N-氧化物 (CAS 5615-07-6) is a chemical compound with molecular formula C20H23ClN2O2S and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯鲁坎酮N-氧化物
6-chloro-N-[2-(diethylamino)ethyl]-4-methyl-9-oxothioxanthen-1-amine oxide
Also Known As: Chlorolucanthone N-oxide, Chlorolucnnthone N-oxide, 9H-Thioxanthen-9-one, 6-chloro-1-((2-(diethylamino)ethyl)amino)-4-methyl-, N-oxide, Thioxanthen-9-one, 6-chloro-1-((2-(diethylamino)ethyl)amino)-4-methyl-, N-oxide, 6-chloro-N-(2-diethylaminoethyl)-4-methyl-9-oxothioxanthen-1-amine oxide
| Molecular Formula | C20H23ClN2O2S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 67.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 390.11688 |
| Heavy Atoms | 26 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 5615-07-6 |
|---|---|
| SMILES | CCN(CC)CC[NH+](C1=C2C(=C(C=C1)C)SC3=C(C2=O)C=CC(=C3)Cl)[O-] |
| InChIKey | ZMGNAXQRGPSUQT-UHFFFAOYSA-N |
Product Overview
氯鲁坎酮N-氧化物 (CAS 5615-07-6), with molecular formula C20H23ClN2O2S and molecular weight 390.12 g/mol. IUPAC: 6-chloro-N-[2-(diethylamino)ethyl]-4-methyl-9-oxothioxanthen-1-amine oxide.
Chemical Property Profile of 氯鲁坎酮N-氧化物
Property Insights of 氯鲁坎酮N-氧化物
The XLogP value of 5.4 indicates that 氯鲁坎酮N-氧化物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 氯鲁坎酮N-氧化物. Following Lipinski's Rule of Five, 氯鲁坎酮N-氧化物 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 氯鲁坎酮N-氧化物?
The CAS number of 氯鲁坎酮N-氧化物 is 5615-07-6.
What is the molecular formula of 氯鲁坎酮N-氧化物?
The molecular formula of 氯鲁坎酮N-氧化物 is C20H23ClN2O2S.
What is the molecular weight of 氯鲁坎酮N-氧化物?
The molecular weight of 氯鲁坎酮N-氧化物 is 390.12 g/mol.
Where can I buy 氯鲁坎酮N-氧化物?
You can request a quote for 氯鲁坎酮N-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯鲁坎酮N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 氯鲁坎酮N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.