Mdl 73404
TL;DR: Mdl 73404 (CAS 130573-32-9) is a chemical compound with molecular formula C25H37NO5S and molecular weight 463.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)ethyl-trimethylazanium;4-methylbenzenesulfonate
Also Known As: DHHBE, Mdl 73404, Mdl 74,405, MDL 74405, 2-(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)ethyl-trimethylazanium;4-methylbenzenesulfonate
| Molecular Formula | C25H37NO5S |
|---|---|
| Molecular Weight | 463.24 g/mol |
| LogP | 4.39658 |
| Topological Polar Surface Area | 95.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 463.23926 |
| Heavy Atoms | 32 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 130573-32-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=C(C2=C(CCC(O2)(C)CC[N+](C)(C)C)C(=C1O)C)C |
| InChIKey | OCKUZZXXLQTSON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mdl 73404 (CAS 130573-32-9), with molecular formula C25H37NO5S and molecular weight 463.24 g/mol. IUPAC: 2-(6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-2-yl)ethyl-trimethylazanium;4-methylbenzenesulfonate.
Chemical Property Profile of Mdl 73404
Property Insights of Mdl 73404
The XLogP value of 4.39658 indicates that Mdl 73404 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Mdl 73404. Following Lipinski's Rule of Five, Mdl 73404 has 1 hydrogen bond donor(s) and 5 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 Mdl 73404?
The CAS number of Mdl 73404 is 130573-32-9.
What is the molecular formula of Mdl 73404?
The molecular formula of Mdl 73404 is C25H37NO5S.
What is the molecular weight of Mdl 73404?
The molecular weight of Mdl 73404 is 463.24 g/mol.
Where can I buy Mdl 73404?
You can request a quote for Mdl 73404 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mdl 73404?
Yes, KEHONG BIO provides custom synthesis services for Mdl 73404 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.