F1601-0080
TL;DR: F1601-0080 (CAS 865655-46-5) is a chemical compound with molecular formula C26H24ClN3O3S and molecular weight 493.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-chlorophenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]-N-(2-methylphenyl)acetamide
Also Known As: F1601-0080, 2-(3-(4-chlorophenyl)-2,4-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1-yl)-N-(o-tolyl)acetamide, 2-[4-(4-chlorophenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2(7)-dien-6-yl]-N-(2-methylphenyl)acetamide, 2-[4-(4-chlorophenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]-N-(2-methylphenyl)acetamide
| Molecular Formula | C26H24ClN3O3S |
|---|---|
| Molecular Weight | 493.12 g/mol |
| LogP | 5.08332 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 493.12268 |
| Heavy Atoms | 34 |
| Complexity | 1515.5637 |
Chemical Identifiers
| CAS Number | 865655-46-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CN2C3=C(C4=C(S3)CCCCC4)C(=O)N(C2=O)C5=CC=C(C=C5)Cl |
Product Overview
F1601-0080 (CAS 865655-46-5), with molecular formula C26H24ClN3O3S and molecular weight 493.12 g/mol. IUPAC: 2-[4-(4-chlorophenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]-N-(2-methylphenyl)acetamide.
Chemical Property Profile of F1601-0080
Property Insights of F1601-0080
The XLogP value of 5.08332 indicates that F1601-0080 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for F1601-0080. Following Lipinski's Rule of Five, F1601-0080 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1601-0080?
The CAS number of F1601-0080 is 865655-46-5.
What is the molecular formula of F1601-0080?
The molecular formula of F1601-0080 is C26H24ClN3O3S.
What is the molecular weight of F1601-0080?
The molecular weight of F1601-0080 is 493.12 g/mol.
Where can I buy F1601-0080?
You can request a quote for F1601-0080 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1601-0080?
Yes, KEHONG BIO provides custom synthesis services for F1601-0080 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.