F1285-1832
TL;DR: F1285-1832 (CAS 540500-00-3) is a chemical compound with molecular formula C29H25FN4OS and molecular weight 496.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
Also Known As: F1285-1832, 1-(4-fluorophenyl)-4-(4-methoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,3,4a-triazacyclopenta[cd]azulene-2-carbothioamide, 6-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-phenyl-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene-5-carbothioamide, 4-(4-fluorophenyl)-1-(4-methoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide, 6-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide
| Molecular Formula | C29H25FN4OS |
|---|---|
| Molecular Weight | 496.17 g/mol |
| LogP | 6.7414 |
| Topological Polar Surface Area | 43.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.1733 |
| Heavy Atoms | 36 |
| Complexity | 1553.6875 |
Chemical Identifiers
| CAS Number | 540500-00-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)F)C(=S)NC6=CC=CC=C6 |
Product Overview
F1285-1832 (CAS 540500-00-3), with molecular formula C29H25FN4OS and molecular weight 496.17 g/mol. IUPAC: 6-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carbothioamide.
Chemical Property Profile of F1285-1832
Property Insights of F1285-1832
The XLogP value of 6.7414 indicates that F1285-1832 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.49 Ų, F1285-1832 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1285-1832 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1285-1832?
The CAS number of F1285-1832 is 540500-00-3.
What is the molecular formula of F1285-1832?
The molecular formula of F1285-1832 is C29H25FN4OS.
What is the molecular weight of F1285-1832?
The molecular weight of F1285-1832 is 496.17 g/mol.
Where can I buy F1285-1832?
You can request a quote for F1285-1832 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1285-1832?
Yes, KEHONG BIO provides custom synthesis services for F1285-1832 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.