AF-399/41980798
TL;DR: AF-399/41980798 (CAS 618408-75-6) is a chemical compound with molecular formula C22H25N3O2S and molecular weight 395.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4,5-dimethyl-3-[(4-phenylpiperazin-1-yl)methyl]thiophen-2-yl]furan-2-carboxamide
Also Known As: AF-399/41980798, F1396-0174, N-(4,5-dimethyl-3-((4-phenylpiperazin-1-yl)methyl)thiophen-2-yl)furan-2-carboxamide, N-[4,5-dimethyl-3-[(4-phenylpiperazin-1-yl)methyl]thiophen-2-yl]furan-2-carboxamide, N-{4,5-dimethyl-3-[(4-phenylpiperazin-1-yl)methyl]thiophen-2-yl}furan-2-carboxamide
| Molecular Formula | C22H25N3O2S |
|---|---|
| Molecular Weight | 395.17 g/mol |
| LogP | 4.53244 |
| Topological Polar Surface Area | 48.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.16675 |
| Heavy Atoms | 28 |
| Complexity | 926.3599 |
Chemical Identifiers
| CAS Number | 618408-75-6 |
|---|---|
| SMILES | CC1=C(SC(=C1CN2CCN(CC2)C3=CC=CC=C3)NC(=O)C4=CC=CO4)C |
Product Overview
AF-399/41980798 (CAS 618408-75-6), with molecular formula C22H25N3O2S and molecular weight 395.17 g/mol. IUPAC: N-[4,5-dimethyl-3-[(4-phenylpiperazin-1-yl)methyl]thiophen-2-yl]furan-2-carboxamide.
Chemical Property Profile of AF-399/41980798
Property Insights of AF-399/41980798
The XLogP value of 4.53244 indicates that AF-399/41980798 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.72 Ų, AF-399/41980798 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/41980798 has 1 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 AF-399/41980798?
The CAS number of AF-399/41980798 is 618408-75-6.
What is the molecular formula of AF-399/41980798?
The molecular formula of AF-399/41980798 is C22H25N3O2S.
What is the molecular weight of AF-399/41980798?
The molecular weight of AF-399/41980798 is 395.17 g/mol.
Where can I buy AF-399/41980798?
You can request a quote for AF-399/41980798 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41980798?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41980798 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.