F2561-0031
TL;DR: F2561-0031 (CAS 877814-10-3) is a chemical compound with molecular formula C24H26N4O2 and molecular weight 402.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethoxy-N-[(6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-2-yl)methyl]aniline
Also Known As: F2561-0031, 2,4-dimethoxy-N-((1-phenyl-5,6,7,8-tetrahydro-2a,3,4a-triazacyclopenta[cd]azulen-4-yl)methyl)aniline, 2,4-dimethoxy-N-({6-phenyl-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-trien-2-yl}methyl)aniline, 2,4-dimethoxy-N-[(6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-2-yl)methyl]aniline
| Molecular Formula | C24H26N4O2 |
|---|---|
| Molecular Weight | 402.21 g/mol |
| LogP | 4.7684 |
| Topological Polar Surface Area | 52.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.20557 |
| Heavy Atoms | 30 |
| Complexity | 1177.1096 |
Chemical Identifiers
| CAS Number | 877814-10-3 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NCC2=NN3C=C(C4=C3N2CCCC4)C5=CC=CC=C5)OC |
Product Overview
F2561-0031 (CAS 877814-10-3), with molecular formula C24H26N4O2 and molecular weight 402.21 g/mol. IUPAC: 2,4-dimethoxy-N-[(6-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-trien-2-yl)methyl]aniline.
Chemical Property Profile of F2561-0031
Property Insights of F2561-0031
The XLogP value of 4.7684 indicates that F2561-0031 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.72 Ų, F2561-0031 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F2561-0031 has 1 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 F2561-0031?
The CAS number of F2561-0031 is 877814-10-3.
What is the molecular formula of F2561-0031?
The molecular formula of F2561-0031 is C24H26N4O2.
What is the molecular weight of F2561-0031?
The molecular weight of F2561-0031 is 402.21 g/mol.
Where can I buy F2561-0031?
You can request a quote for F2561-0031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2561-0031?
Yes, KEHONG BIO provides custom synthesis services for F2561-0031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.