F1601-0580
TL;DR: F1601-0580 (CAS 866015-89-6) is a chemical compound with molecular formula C22H17ClN2O2S and molecular weight 408.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[(2-chlorophenyl)methyl]-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-diene-10,12-dione
Also Known As: F1601-0580, 1-(2-chlorobenzyl)-3-phenyl-6,7-dihydro-1H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H,5H)-dione, 9-[(2-chlorophenyl)methyl]-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6)-diene-10,12-dione, 1-(2-chlorobenzyl)-3-phenyl-1,5,6,7-tetrahydro-2H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione, 9-[(2-chlorophenyl)methyl]-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-diene-10,12-dione
| Molecular Formula | C22H17ClN2O2S |
|---|---|
| Molecular Weight | 408.07 g/mol |
| LogP | 4.4043 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.06992 |
| Heavy Atoms | 28 |
| Complexity | 1318.3623 |
Chemical Identifiers
| CAS Number | 866015-89-6 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=C2C(=O)N(C(=O)N3CC4=CC=CC=C4Cl)C5=CC=CC=C5 |
Product Overview
F1601-0580 (CAS 866015-89-6), with molecular formula C22H17ClN2O2S and molecular weight 408.07 g/mol. IUPAC: 9-[(2-chlorophenyl)methyl]-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-diene-10,12-dione.
Chemical Property Profile of F1601-0580
Property Insights of F1601-0580
The XLogP value of 4.4043 indicates that F1601-0580 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.0 Ų, F1601-0580 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1601-0580 has 0 hydrogen bond donor(s) and 3 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 F1601-0580?
The CAS number of F1601-0580 is 866015-89-6.
What is the molecular formula of F1601-0580?
The molecular formula of F1601-0580 is C22H17ClN2O2S.
What is the molecular weight of F1601-0580?
The molecular weight of F1601-0580 is 408.07 g/mol.
Where can I buy F1601-0580?
You can request a quote for F1601-0580 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1601-0580?
Yes, KEHONG BIO provides custom synthesis services for F1601-0580 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.