F1016-0824
TL;DR: F1016-0824 (CAS 403844-75-7) is a chemical compound with molecular formula C18H24N4O3S2 and molecular weight 408.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: F1016-0824, ethyl 2-(2-((4-methyl-4H-1,2,4-triazol-3-yl)thio)propanamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-{2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]propanamido}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
| Molecular Formula | C18H24N4O3S2 |
|---|---|
| Molecular Weight | 408.13 g/mol |
| LogP | 3.4415 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.129 |
| Heavy Atoms | 27 |
| Complexity | 830.68353 |
Chemical Identifiers
| CAS Number | 403844-75-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C(C)SC3=NN=CN3C |
Product Overview
F1016-0824 (CAS 403844-75-7), with molecular formula C18H24N4O3S2 and molecular weight 408.13 g/mol. IUPAC: ethyl 2-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]propanoylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.
Chemical Property Profile of F1016-0824
Property Insights of F1016-0824
The XLogP value of 3.4415 indicates that F1016-0824 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for F1016-0824. Following Lipinski's Rule of Five, F1016-0824 has 1 hydrogen bond donor(s) and 7 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 F1016-0824?
The CAS number of F1016-0824 is 403844-75-7.
What is the molecular formula of F1016-0824?
The molecular formula of F1016-0824 is C18H24N4O3S2.
What is the molecular weight of F1016-0824?
The molecular weight of F1016-0824 is 408.13 g/mol.
Where can I buy F1016-0824?
You can request a quote for F1016-0824 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1016-0824?
Yes, KEHONG BIO provides custom synthesis services for F1016-0824 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.