F1678-0045
TL;DR: F1678-0045 (CAS 726147-69-9) is a chemical compound with molecular formula C14H17N3OS2 and molecular weight 307.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetamide
Also Known As: F1678-0045, N,N-dimethyl-2-(2-methyl(5,6,7-trihydrocyclopenta[2,1-d]pyrimidino[4,5-b]thiop hen-4-ylthio))acetamide, N,N-dimethyl-2-((2-methyl-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)acetamide, N,N-dimethyl-2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetamide
| Molecular Formula | C14H17N3OS2 |
|---|---|
| Molecular Weight | 307.08 g/mol |
| LogP | 2.66872 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.0813 |
| Heavy Atoms | 20 |
| Complexity | 678.5991 |
Chemical Identifiers
| CAS Number | 726147-69-9 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCC3)C(=N1)SCC(=O)N(C)C |
Product Overview
F1678-0045 (CAS 726147-69-9), with molecular formula C14H17N3OS2 and molecular weight 307.08 g/mol. IUPAC: N,N-dimethyl-2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]acetamide.
Chemical Property Profile of F1678-0045
Property Insights of F1678-0045
The XLogP value of 2.66872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1678-0045. With a topological polar surface area (TPSA) of 46.09 Ų, F1678-0045 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1678-0045 has 0 hydrogen bond donor(s) and 5 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 F1678-0045?
The CAS number of F1678-0045 is 726147-69-9.
What is the molecular formula of F1678-0045?
The molecular formula of F1678-0045 is C14H17N3OS2.
What is the molecular weight of F1678-0045?
The molecular weight of F1678-0045 is 307.08 g/mol.
Where can I buy F1678-0045?
You can request a quote for F1678-0045 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1678-0045?
Yes, KEHONG BIO provides custom synthesis services for F1678-0045 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.