吡羅克酮乙醇胺鹽
TL;DR: 吡羅克酮乙醇胺鹽 (CAS 68890-66-4) is a chemical compound with molecular formula C16H30N2O3 and molecular weight 298.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡羅克酮乙醇胺鹽
2-aminoethanol;1-hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)pyridin-2-one
Also Known As: PIROCTONE OLAMINE, Octopirox, Octopyrox, Kopirox, Piroctoneolamine
| Molecular Formula | C16H30N2O3 |
|---|---|
| Molecular Weight | 298.23 g/mol |
| LogP | 1.95 |
| Topological Polar Surface Area | 86.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.22565 |
| Heavy Atoms | 21 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 68890-66-4 |
|---|---|
| SMILES | CC1=CC(=O)N(C(=C1)CC(C)CC(C)(C)C)O.C(CO)N |
| InChIKey | BTSZTGGZJQFALU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吡羅克酮乙醇胺鹽 (CAS 68890-66-4), with molecular formula C16H30N2O3 and molecular weight 298.23 g/mol. IUPAC: 2-aminoethanol;1-hydroxy-4-methyl-6-(2,4,4-trimethylpentyl)pyridin-2-one.
Chemical Property Profile of 吡羅克酮乙醇胺鹽
Property Insights of 吡羅克酮乙醇胺鹽
The XLogP value of 1.95 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 吡羅克酮乙醇胺鹽. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 吡羅克酮乙醇胺鹽. Following Lipinski's Rule of Five, 吡羅克酮乙醇胺鹽 has 3 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 吡羅克酮乙醇胺鹽?
The CAS number of 吡羅克酮乙醇胺鹽 is 68890-66-4.
What is the molecular formula of 吡羅克酮乙醇胺鹽?
The molecular formula of 吡羅克酮乙醇胺鹽 is C16H30N2O3.
What is the molecular weight of 吡羅克酮乙醇胺鹽?
The molecular weight of 吡羅克酮乙醇胺鹽 is 298.23 g/mol.
Where can I buy 吡羅克酮乙醇胺鹽?
You can request a quote for 吡羅克酮乙醇胺鹽 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡羅克酮乙醇胺鹽?
Yes, KEHONG BIO provides custom synthesis services for 吡羅克酮乙醇胺鹽 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.