F0778-0406
TL;DR: F0778-0406 (CAS 396724-23-5) is a chemical compound with molecular formula C25H31N3OS and molecular weight 421.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-adamantyl)-N-[2-(2,4-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]acetamide
Also Known As: F0778-0406, 2-(adamantan-1-yl)-N-[2-(2,4-dimethylphenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]acetamide, 2-(1-adamantyl)-N-[2-(2,4-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]acetamide, 2-((3r,5r,7r)-adamantan-1-yl)-N-(2-(2,4-dimethylphenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)acetamide
| Molecular Formula | C25H31N3OS |
|---|---|
| Molecular Weight | 421.22 g/mol |
| LogP | 5.78094 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.21878 |
| Heavy Atoms | 30 |
| Complexity | 988.3571 |
Chemical Identifiers
| CAS Number | 396724-23-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=C3CSCC3=N2)NC(=O)CC45CC6CC(C4)CC(C6)C5)C |
Product Overview
F0778-0406 (CAS 396724-23-5), with molecular formula C25H31N3OS and molecular weight 421.22 g/mol. IUPAC: 2-(1-adamantyl)-N-[2-(2,4-dimethylphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]acetamide.
Chemical Property Profile of F0778-0406
Property Insights of F0778-0406
The XLogP value of 5.78094 indicates that F0778-0406 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, F0778-0406 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0778-0406 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0778-0406?
The CAS number of F0778-0406 is 396724-23-5.
What is the molecular formula of F0778-0406?
The molecular formula of F0778-0406 is C25H31N3OS.
What is the molecular weight of F0778-0406?
The molecular weight of F0778-0406 is 421.22 g/mol.
Where can I buy F0778-0406?
You can request a quote for F0778-0406 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0778-0406?
Yes, KEHONG BIO provides custom synthesis services for F0778-0406 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.