F1016-0735
TL;DR: F1016-0735 (CAS 403843-89-0) is a chemical compound with molecular formula C20H22ClNO3S2 and molecular weight 423.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: F1016-0735, ethyl 2-{2-[(4-chlorophenyl)sulfanyl]acetamido}-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-(2-((4-chlorophenyl)thio)acetamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate, ethyl 2-{[(p-chlorophenylthio)methyl]carbonylamino}-1-thia-5,6,7,8-tetrahydro-4H-azulene-3-carboxylate
| Molecular Formula | C20H22ClNO3S2 |
|---|---|
| Molecular Weight | 423.07 g/mol |
| LogP | 5.5779 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.07297 |
| Heavy Atoms | 27 |
| Complexity | 817.37946 |
Chemical Identifiers
| CAS Number | 403843-89-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CSC3=CC=C(C=C3)Cl |
Product Overview
F1016-0735 (CAS 403843-89-0), with molecular formula C20H22ClNO3S2 and molecular weight 423.07 g/mol. IUPAC: ethyl 2-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.
Chemical Property Profile of F1016-0735
Property Insights of F1016-0735
The XLogP value of 5.5779 indicates that F1016-0735 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, F1016-0735 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1016-0735 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1016-0735?
The CAS number of F1016-0735 is 403843-89-0.
What is the molecular formula of F1016-0735?
The molecular formula of F1016-0735 is C20H22ClNO3S2.
What is the molecular weight of F1016-0735?
The molecular weight of F1016-0735 is 423.07 g/mol.
Where can I buy F1016-0735?
You can request a quote for F1016-0735 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1016-0735?
Yes, KEHONG BIO provides custom synthesis services for F1016-0735 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.