AF-399/41704207
TL;DR: AF-399/41704207 (CAS 608495-01-8) is a chemical compound with molecular formula C15H15FN2O2S and molecular weight 306.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 4-(2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: AF-399/41704207, allyl 4-(2-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, prop-2-enyl 4-(2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, prop-2-en-1-yl 4-(2-fluorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C15H15FN2O2S |
|---|---|
| Molecular Weight | 306.08 g/mol |
| LogP | 2.3477 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.08383 |
| Heavy Atoms | 21 |
| Complexity | 627.85455 |
Chemical Identifiers
| CAS Number | 608495-01-8 |
|---|---|
| SMILES | CC1=C(C(NC(=S)N1)C2=CC=CC=C2F)C(=O)OCC=C |
Product Overview
AF-399/41704207 (CAS 608495-01-8), with molecular formula C15H15FN2O2S and molecular weight 306.08 g/mol. IUPAC: prop-2-enyl 4-(2-fluorophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of AF-399/41704207
Property Insights of AF-399/41704207
The XLogP value of 2.3477 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF-399/41704207. With a topological polar surface area (TPSA) of 50.36 Ų, AF-399/41704207 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/41704207 has 2 hydrogen bond donor(s) and 3 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-399/41704207?
The CAS number of AF-399/41704207 is 608495-01-8.
What is the molecular formula of AF-399/41704207?
The molecular formula of AF-399/41704207 is C15H15FN2O2S.
What is the molecular weight of AF-399/41704207?
The molecular weight of AF-399/41704207 is 306.08 g/mol.
Where can I buy AF-399/41704207?
You can request a quote for AF-399/41704207 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/41704207?
Yes, KEHONG BIO provides custom synthesis services for AF-399/41704207 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.