AF-399/15599183
TL;DR: AF-399/15599183 (CAS 315708-59-9) is a chemical compound with molecular formula C21H19FN2O2S2 and molecular weight 414.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: AF-399/15599183, 2-[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 3-allyl-2-{[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2-[2-(2-fluorophenyl)-2-oxoethylthio]-3-prop-2-enyl-3,5,6,7,8-pentahydrobenzo[ b]thiopheno[2,3-d]pyrimidin-4-one, 5-{[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one
| Molecular Formula | C21H19FN2O2S2 |
|---|---|
| Molecular Weight | 414.09 g/mol |
| LogP | 4.6369 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.0872 |
| Heavy Atoms | 28 |
| Complexity | 1133.3713 |
Chemical Identifiers
| CAS Number | 315708-59-9 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=CC=C3F)SC4=C2CCCC4 |
Product Overview
AF-399/15599183 (CAS 315708-59-9), with molecular formula C21H19FN2O2S2 and molecular weight 414.09 g/mol. IUPAC: 2-[2-(2-fluorophenyl)-2-oxoethyl]sulfanyl-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AF-399/15599183
Property Insights of AF-399/15599183
The XLogP value of 4.6369 indicates that AF-399/15599183 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, AF-399/15599183 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/15599183 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 AF-399/15599183?
The CAS number of AF-399/15599183 is 315708-59-9.
What is the molecular formula of AF-399/15599183?
The molecular formula of AF-399/15599183 is C21H19FN2O2S2.
What is the molecular weight of AF-399/15599183?
The molecular weight of AF-399/15599183 is 414.09 g/mol.
Where can I buy AF-399/15599183?
You can request a quote for AF-399/15599183 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/15599183?
Yes, KEHONG BIO provides custom synthesis services for AF-399/15599183 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.