AF-399/12856050
TL;DR: AF-399/12856050 (CAS 306280-65-9) is a chemical compound with molecular formula C15H15F2N3OS2 and molecular weight 355.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[2-(difluoromethoxy)phenyl]-5-methyl-1,3-thiazol-2-yl]-3-prop-2-enylthiourea
Also Known As: AF-399/12856050, 1-{4-[2-(difluoromethoxy)phenyl]-5-methyl-1,3-thiazol-2-yl}-3-prop-2-en-1-ylthiourea, 1-allyl-3-(4-(2-(difluoromethoxy)phenyl)-5-methylthiazol-2-yl)thiourea, 1-[4-[2-(difluoromethoxy)phenyl]-5-methyl-1,3-thiazol-2-yl]-3-prop-2-enylthiourea, N-allyl-N'-{4-[2-(difluoromethoxy)phenyl]-5-methyl-1,3-thiazol-2-yl}carbamimidothioic acid
| Molecular Formula | C15H15F2N3OS2 |
|---|---|
| Molecular Weight | 355.06 g/mol |
| LogP | 4.19232 |
| Topological Polar Surface Area | 46.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.06247 |
| Heavy Atoms | 23 |
| Complexity | 703.78046 |
Chemical Identifiers
| CAS Number | 306280-65-9 |
|---|---|
| SMILES | CC1=C(N=C(S1)NC(=S)NCC=C)C2=CC=CC=C2OC(F)F |
Product Overview
AF-399/12856050 (CAS 306280-65-9), with molecular formula C15H15F2N3OS2 and molecular weight 355.06 g/mol. IUPAC: 1-[4-[2-(difluoromethoxy)phenyl]-5-methyl-1,3-thiazol-2-yl]-3-prop-2-enylthiourea.
Chemical Property Profile of AF-399/12856050
Property Insights of AF-399/12856050
The XLogP value of 4.19232 indicates that AF-399/12856050 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.18 Ų, AF-399/12856050 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/12856050 has 2 hydrogen bond donor(s) and 4 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-399/12856050?
The CAS number of AF-399/12856050 is 306280-65-9.
What is the molecular formula of AF-399/12856050?
The molecular formula of AF-399/12856050 is C15H15F2N3OS2.
What is the molecular weight of AF-399/12856050?
The molecular weight of AF-399/12856050 is 355.06 g/mol.
Where can I buy AF-399/12856050?
You can request a quote for AF-399/12856050 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/12856050?
Yes, KEHONG BIO provides custom synthesis services for AF-399/12856050 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.