1-芘甲胺
TL;DR: 1-芘甲胺 (CAS 3786-54-7) is a chemical compound with molecular formula C17H13N and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-芘甲胺
pyren-1-ylmethanamine
Also Known As: Pyren-1-ylmethanamine, 1-Pyrenemethanamine, 1-pyrenemethylamine, aminomethylpyrene, 1-aminomethylpyrene
| Molecular Formula | C17H13N |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 4.0427 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.1048 |
| Heavy Atoms | 18 |
| Complexity | 845.3562 |
Chemical Identifiers
| CAS Number | 3786-54-7 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CN |
Product Overview
1-芘甲胺 (CAS 3786-54-7), with molecular formula C17H13N and molecular weight 231.10 g/mol. IUPAC: pyren-1-ylmethanamine.
Chemical Property Profile of 1-芘甲胺
Property Insights of 1-芘甲胺
The XLogP value of 4.0427 indicates that 1-芘甲胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 1-芘甲胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-芘甲胺 has 1 hydrogen bond donor(s) and 1 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 1-芘甲胺?
The CAS number of 1-芘甲胺 is 3786-54-7.
What is the molecular formula of 1-芘甲胺?
The molecular formula of 1-芘甲胺 is C17H13N.
What is the molecular weight of 1-芘甲胺?
The molecular weight of 1-芘甲胺 is 231.10 g/mol.
Where can I buy 1-芘甲胺?
You can request a quote for 1-芘甲胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-芘甲胺?
Yes, KEHONG BIO provides custom synthesis services for 1-芘甲胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.