班布特罗单氨基甲酸酯
TL;DR: 班布特罗单氨基甲酸酯 (CAS 86433-40-1) is a chemical compound with molecular formula C15H24N2O4 and molecular weight 296.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
班布特罗单氨基甲酸酯
[3-[2-(tert-butylamino)-1-hydroxyethyl]-5-hydroxyphenyl] N,N-dimethylcarbamate
Also Known As: Bambuterol Monocarbamate, Bambuterol EP Impurity C, Monocarbamate bambuterol, D-2439, D 2439
| Molecular Formula | C15H24N2O4 |
|---|---|
| Molecular Weight | 296.17 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 82.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.1736 |
| Heavy Atoms | 21 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 86433-40-1 |
|---|---|
| SMILES | CC(C)(C)NCC(C1=CC(=CC(=C1)OC(=O)N(C)C)O)O |
| InChIKey | ZFYNJGOPBVNUDF-UHFFFAOYSA-N |
Product Overview
班布特罗单氨基甲酸酯 (CAS 86433-40-1), with molecular formula C15H24N2O4 and molecular weight 296.17 g/mol. IUPAC: [3-[2-(tert-butylamino)-1-hydroxyethyl]-5-hydroxyphenyl] N,N-dimethylcarbamate.
Chemical Property Profile of 班布特罗单氨基甲酸酯
Property Insights of 班布特罗单氨基甲酸酯
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 班布特罗单氨基甲酸酯. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 班布特罗单氨基甲酸酯. Following Lipinski's Rule of Five, 班布特罗单氨基甲酸酯 has 3 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 班布特罗单氨基甲酸酯?
The CAS number of 班布特罗单氨基甲酸酯 is 86433-40-1.
What is the molecular formula of 班布特罗单氨基甲酸酯?
The molecular formula of 班布特罗单氨基甲酸酯 is C15H24N2O4.
What is the molecular weight of 班布特罗单氨基甲酸酯?
The molecular weight of 班布特罗单氨基甲酸酯 is 296.17 g/mol.
Where can I buy 班布特罗单氨基甲酸酯?
You can request a quote for 班布特罗单氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 班布特罗单氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 班布特罗单氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.