Asthma relating compound 1
TL;DR: Asthma relating compound 1 (CAS 120165-51-7) is a chemical compound with molecular formula C17H19N3O3S2 and molecular weight 377.0868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide
Also Known As: Asthma relating compound 1, HY-U00412, 4-[[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide, E-6080, 4-(((6-Hydroxy-4,5,7-trimethylbenzo[d]thiazol-2-yl)amino)methyl)benzenesulfonamide
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H19N3O3S2 |
| Molecular Weight | 377.0868 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.0868 Da |
| Heavy Atoms | 25 |
| Complexity | 560.0 |
| SMILES | CC1=C(C(=C(C2=C1N=C(S2)NCC3=CC=C(C=C3)S(=O)(=O)N)C)O)C |
| InChIKey | IKIAJUVGDUYASS-UHFFFAOYSA-N |
Chemical Property Profile of Asthma relating compound 1
Property Insights of Asthma relating compound 1
The XLogP value of 3.5 indicates that Asthma relating compound 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting Asthma relating compound 1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Asthma relating compound 1 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Asthma relating compound 1?
The CAS number of Asthma relating compound 1 is 120165-51-7.
What is the molecular formula of Asthma relating compound 1?
The molecular formula of Asthma relating compound 1 is C17H19N3O3S2.
What is the molecular weight of Asthma relating compound 1?
The molecular weight of Asthma relating compound 1 is 377.0868 g/mol.
Where can I buy Asthma relating compound 1?
You can request a quote for Asthma relating compound 1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Asthma relating compound 1?
Yes, CoreyChem provides custom synthesis services for Asthma relating compound 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.